data_6n2m_residue ############################ # Computer software used # ############################ 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 6n2m _Structure_validation_residue.Date_analyzed 2019-07-12 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' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 120.338 0.114 . . . . 74.54 111.082 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 71.23 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.605 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 71.31 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 75.32 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 73.3 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 73.41 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 63.2 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 74.11 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 65.31 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.663 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.549 HG11 HD22 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 74.43 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 74.32 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.587 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.407 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.467 HG22 HD13 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 71.44 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 73.21 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 75.23 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 72.34 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 73.5 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 74.05 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.467 HD13 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.13 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 73.44 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 71.22 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.686 ' HB3' HD11 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 75.24 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 75.12 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 74.33 110.744 173.434 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.467 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt . . . . . 0 CA--C 1.56 1.329 0 N-CA-C 111.676 0.25 . . . . 74.04 111.676 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 74.15 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.587 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 73.02 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.663 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 75.31 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 74.01 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 75.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.702 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 75.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.55 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 75.13 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.407 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 73.13 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.605 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.43 ' HD2' ' HE2' ' A' ' 105' ' ' MET . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.4 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 74.4 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 63.43 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.458 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.55 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.5 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.498 HD22 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 73.33 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.551 ' HG3' HD21 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.551 HD21 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.458 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 75.11 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 93' ' ' LYS . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.45 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.21 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 74.24 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 70.44 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 75.33 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.481 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.43 ' HE2' ' HD2' ' A' ' 74' ' ' LYS . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 74.42 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 73.42 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 73.04 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 71.02 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.25 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 74.41 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.602 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 73.21 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.498 ' HG2' HD22 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 71.34 110.985 -177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 75.22 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 64.04 110.367 175.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 72.12 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG21 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.5 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 74.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.635 HG21 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 64.41 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.408 ' HB2' HD12 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 73.53 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 74.31 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.514 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 10.0 mtpm? . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 109.658 -0.497 . . . . 63.54 109.658 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . 0.515 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.516 ' HZ3' HD23 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 74.42 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 75.54 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 65.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.428 HG22 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 72.24 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.531 HD21 HD11 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.738 HG11 HD23 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 71.14 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.416 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 74.43 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.64 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 74.43 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.416 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.64 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 75.24 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.476 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 73.11 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 75.42 110.97 169.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.538 ' HG3' HD13 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 62.15 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.58 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 63.12 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.457 HD22 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 74.31 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 73.13 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . 0.465 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 64.35 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.448 ' HB3' HG22 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 62.11 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.457 ' HB3' HD22 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 74.22 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 74.1 109.851 168.558 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.413 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt . . . . . 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 65.13 112.798 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 74.3 114.231 -178.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 75.42 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 72.2 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.578 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.497 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 74.41 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 74.34 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.516 HD23 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 65.33 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.448 HG22 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 74.35 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 74.34 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . 0.515 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 64.11 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.501 ' HD2' ' HE3' ' B' ' 105' ' ' MET . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 72.44 112.147 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 74.32 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 74.43 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 74.31 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.464 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 62.35 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 74.12 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 72.51 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 74.34 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD21 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.43 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.454 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 72.44 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.738 HD23 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 74.12 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 73.45 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.644 ' HB2' ' HZ1' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 70.51 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 73.22 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.491 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 44.24 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.491 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 74.22 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 73.4 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 71.34 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 55.23 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.602 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 74.45 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.439 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 73.44 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' SER . . . . . 0.407 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.501 ' HE3' ' HD2' ' B' ' 74' ' ' LYS . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.46 HD13 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 73.01 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 73.43 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD13 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 52.03 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 73.35 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 75.15 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 74.23 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.538 HD13 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 71.45 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.452 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.502 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 74.31 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.501 HG12 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.502 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 75.12 109.815 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 61.43 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 71.44 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.425 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 74.21 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.407 HG22 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.569 ' HA ' HG21 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 75.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 73.43 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' B' ' 137' ' ' LEU . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 72.0 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.569 HG21 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 71.4 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.481 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.452 HD21 ' HD2' ' A' ' 140' ' ' LYS . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 73.12 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' B' ' 140' ' ' LYS . 8.6 mtpm? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 75.24 112.116 -177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 112.127 0.417 . . . . 74.54 112.127 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 71.23 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 71.31 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 75.32 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 73.3 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 73.41 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 63.2 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 74.11 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 65.31 111.509 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.599 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.428 ' HB ' HD11 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 74.43 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.436 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 74.32 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.508 ' O ' HG22 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.508 HG22 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 71.44 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.52 ' HH ' ' HG3' ' A' ' 122' ' ' GLU . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 73.21 112.401 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 75.23 111.748 174.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 72.34 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.426 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 73.5 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 74.05 112.625 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.13 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 73.44 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 71.22 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 75.24 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 75.12 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 74.33 113.398 -177.83 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp . . . . . 0 CA--C 1.557 1.226 0 N-CA-C 112.015 0.376 . . . . 74.04 112.015 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.599 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 74.15 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.462 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 73.02 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.455 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 75.31 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 74.01 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 75.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 75.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.55 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 75.13 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 73.13 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 74.4 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 63.43 111.786 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.498 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.55 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.5 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HG ' HG23 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.593 ' HB3' HD22 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 73.33 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.498 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 75.11 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.45 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.21 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 74.24 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.486 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 70.44 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 75.33 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.4 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 74.42 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.538 HG22 HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 73.42 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.594 HD13 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 73.04 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 71.02 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.538 HD21 HG22 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.25 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 74.41 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.466 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 73.21 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.52 ' HG3' ' HH ' ' A' ' 33' ' ' TYR . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 71.34 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 75.22 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 64.04 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.459 HG12 HD13 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 72.12 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.516 ' HA ' HG23 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.5 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 74.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.53 HD12 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.516 HG23 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 64.41 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 73.53 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.652 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 74.31 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 . . . . . 0 CA--C 1.563 1.456 0 CA-C-O 122.023 0.916 . . . . 63.54 110.969 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.404 ' SG ' ' CE1' ' B' ' 73' ' ' HIS . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 74.42 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.514 ' HB ' ' HH ' ' B' ' 76' ' ' TYR . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.597 ' HB3' HD12 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 75.54 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 65.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 72.24 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.597 HD12 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.731 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 71.14 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.456 HD13 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 74.43 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.576 ' HD3' HG23 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 74.43 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.491 HG23 HD12 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 75.24 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 73.11 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 75.42 110.779 171.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 62.15 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 63.12 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.491 HD12 HG23 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 74.31 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 73.13 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 64.35 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 62.11 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.476 HG23 HD11 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 74.22 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' SER . . . . . 0.402 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 74.1 112.062 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.554 1.112 0 CA-C-O 120.654 0.264 . . . . 65.13 111.657 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.592 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 74.3 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 75.42 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 72.2 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.592 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.576 HG23 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 74.41 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.476 HD11 HG23 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 74.34 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 65.33 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 74.35 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 74.34 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 64.11 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.478 ' O ' HG22 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 72.44 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.514 ' HH ' ' HB ' ' B' ' 13' ' ' VAL . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 74.32 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.478 HG22 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 74.43 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 74.31 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 62.35 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 74.12 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 72.51 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 74.34 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.638 ' HB3' HD22 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.43 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 72.44 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.731 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 74.12 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.479 ' HZ1' ' HB3' ' B' ' 92' ' ' LYS . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 73.45 112.905 176.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 70.51 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.543 HG22 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 73.22 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.543 HG23 HG22 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 44.24 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 74.22 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 73.4 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 71.34 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . 0.488 ' HB1' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 55.23 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 74.45 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . 0.488 HG23 ' HB1' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 73.44 114.415 173.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.588 HD11 ' HG ' ' B' ' 110' ' ' SER . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.588 HD13 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 73.01 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 73.43 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' SER . . . . . 0.588 ' HG ' HD11 ' B' ' 106' ' ' ILE . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.588 ' HA ' HD13 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 52.03 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 73.35 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.58 HD11 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 75.15 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.594 HG21 HD13 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 74.23 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 71.45 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.517 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.402 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 74.31 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.517 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.402 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 75.12 110.419 -178.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 61.43 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 71.44 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 74.21 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 75.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.484 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 73.43 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 72.0 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.53 ' HB ' HD12 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 71.4 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.652 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 73.12 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.595 ' HZ1' ' HB3' ' B' ' 140' ' ' LYS . 8.1 mtpm? . . . . . 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 75.24 110.274 169.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.48 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 71.23 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 71.31 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 75.32 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 73.3 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 73.41 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.477 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 63.2 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.694 HG22 ' HZ3' ' A' ' 93' ' ' LYS . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 74.11 111.13 176.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.443 HD23 HD11 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 65.31 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.644 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.465 HG13 HD23 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 74.43 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.42 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 74.32 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.685 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 71.44 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' HD21 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.43 ' HA ' HD11 ' A' ' 118' ' ' LEU . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 73.21 110.275 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 75.23 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 72.34 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 73.5 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 74.05 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.448 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.13 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 73.44 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 71.22 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 75.24 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 75.12 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 74.33 110.59 168.268 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 CA--C 1.55 0.955 0 N-CA-C 112.3 0.481 . . . . 74.04 112.3 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 74.15 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.685 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 73.02 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.644 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 75.31 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 74.01 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.552 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.503 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 75.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.516 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 75.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.55 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.516 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 75.13 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 73.13 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.448 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 74.4 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 63.43 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.4 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.55 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.5 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.442 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.595 ' HB3' HD21 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 73.33 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.595 HD21 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 75.11 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.694 ' HZ3' HG22 ' A' ' 20' ' ' THR . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.45 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.21 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 74.24 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 70.44 115.235 174.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 75.33 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.482 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 74.42 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 73.42 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.482 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 73.04 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 71.02 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD13 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.25 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.448 HD21 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 74.41 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 73.21 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.516 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.434 HG11 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.516 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 71.34 109.935 176.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 75.22 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 64.04 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 72.12 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.5 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 74.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.476 HD11 HG12 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 64.41 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.587 ' HB2' HD12 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 73.53 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 74.31 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' B' ' 73' ' ' HIS . 8.1 p-10 . . . . . 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . 0.405 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.431 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 74.42 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . 0.474 HG13 HG21 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 75.54 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 65.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 72.24 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.587 HG13 HD23 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 71.14 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 74.43 109.405 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.451 ' HB3' HD12 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 74.43 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.503 HG23 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 75.24 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.451 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 73.11 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 75.42 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 62.15 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 63.12 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.579 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 74.31 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 73.13 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 64.35 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.549 ' HA ' HE21 ' B' ' 47' ' ' GLN . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 62.11 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.579 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.549 HE21 ' HA ' ' B' ' 44' ' ' ASP . 29.3 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.509 HG12 ' HB2' ' B' ' 64' ' ' LEU . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.451 HD12 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 74.22 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 74.1 111.587 172.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.43 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 112.529 0.566 . . . . 65.13 112.529 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.492 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 74.3 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 75.42 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.43 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 72.2 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.547 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 74.41 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.432 HG22 HG11 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.509 ' HB2' HG12 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 74.34 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.431 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 65.33 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 74.35 110.762 174.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.451 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 74.34 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . 0.405 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 64.11 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.516 ' HB2' ' H ' ' B' ' 7' ' ' ASP . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 72.44 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.551 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 74.32 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 74.43 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 74.31 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 62.35 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 74.12 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 72.51 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 74.34 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.671 ' HB3' HD21 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.43 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.465 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 72.44 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 74.12 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.424 ' CZ ' HG22 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 73.45 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 70.51 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.711 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 73.22 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.595 HG23 HG22 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 44.24 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 74.22 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 73.4 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.675 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 71.34 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 55.23 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.675 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 74.45 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.404 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 73.44 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' SER . . . . . 0.633 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 73.01 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 73.43 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 52.03 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.472 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 73.35 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 75.15 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 74.23 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 71.45 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.494 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.404 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 74.31 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.404 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 75.12 110.187 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 61.43 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 71.44 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.467 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 74.21 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.476 HG12 HD11 ' A' ' 133' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.7 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 75.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.494 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 73.43 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.509 HD12 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 72.0 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 71.4 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.564 ' HB2' HD12 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 73.12 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 75.24 111.944 -173.762 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 CA--C 1.562 1.42 0 N-CA-C 112.379 0.511 . . . . 74.54 112.379 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 71.23 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 71.31 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 75.32 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 73.3 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 73.41 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 63.2 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 74.11 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.522 HD23 HD13 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 65.31 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.682 HG12 HD22 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 74.43 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.558 HD11 HD12 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 74.32 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.626 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.424 ' HG ' HD11 ' A' ' 49' ' ' LEU . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.402 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.561 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 71.44 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 73.21 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 75.23 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.419 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 72.34 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.544 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 73.5 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.737 ' HA ' ' HZ2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 74.05 112.288 173.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.776 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.13 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 73.44 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.419 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 71.22 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.585 ' HB2' HD11 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 75.24 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.776 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 75.12 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.424 HD11 ' HG ' ' A' ' 28' ' ' SER . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 74.33 110.398 170.049 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 112.168 0.433 . . . . 74.04 112.168 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 74.15 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 73.02 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 75.31 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 74.01 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 75.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.595 HD12 ' HA ' ' A' ' 64' ' ' LEU . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 75.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.55 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 75.13 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 73.13 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.556 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 74.4 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.431 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 63.43 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.544 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.55 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.558 HD12 HD11 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.5 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.681 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 73.33 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.682 HD22 HG12 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.544 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 75.11 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.45 112.337 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.21 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 74.24 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.463 ' HZ1' ' HB3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.48 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 70.44 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 75.33 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.546 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.556 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 74.42 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 73.42 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 73.04 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 71.02 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.546 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.25 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 74.41 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.679 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 73.21 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.466 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 71.34 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 75.22 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 64.04 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 72.12 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.726 ' HA ' HG21 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.5 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 74.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.726 HG21 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 64.41 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.478 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 73.53 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.509 HD12 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 74.31 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.405 ' HD2' HD22 ' B' ' 137' ' ' LEU . 43.3 mtpt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . 0.547 ' H ' ' HA2' ' B' ' 72' ' ' GLY . 29.4 t70 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.432 0.634 . . . . 63.54 111.221 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 74.42 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.445 HD22 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 75.54 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 65.41 111.998 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 72.24 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.559 ' HA ' HD11 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.546 HG21 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.636 HG11 HD22 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 71.14 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 74.43 109.713 175.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.678 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 74.43 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 75.24 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . 0.415 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 73.11 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 75.42 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' B' ' 118' ' ' LEU . 13.9 mm100 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 62.15 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 63.12 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.537 HD23 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 74.31 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 73.13 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 64.35 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.605 ' HB3' HD11 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 62.11 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.537 ' HB3' HD23 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD13 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 74.22 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 74.1 111.412 177.685 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.984 0.421 . . . . 65.13 111.856 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 74.3 114.086 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 75.42 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 72.2 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.678 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 74.41 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 74.34 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 65.33 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.605 HD11 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 74.35 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.593 HD12 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 74.34 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . 0.547 ' HA2' ' H ' ' B' ' 7' ' ' ASP . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 64.11 113.468 -177.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.44 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 72.44 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 74.32 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 74.43 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 74.31 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.593 ' HB2' HD12 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 62.35 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 74.12 111.554 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.495 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 72.51 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 74.34 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.514 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.43 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.625 ' HG3' HD21 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 72.44 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.636 HD22 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 74.12 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 73.45 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 70.51 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.445 ' HB ' HD22 ' B' ' 14' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 73.22 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 44.24 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 74.22 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.68 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 73.4 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 71.34 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 55.23 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.679 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 74.45 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.471 ' O ' HG12 ' B' ' 107' ' ' ILE . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 73.44 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.501 HG21 HD11 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.471 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 73.01 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 73.43 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.468 ' HA ' HD13 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 52.03 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 73.35 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.501 HD11 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 75.15 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 74.23 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 71.45 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.524 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 74.31 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 75.12 109.892 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 61.43 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 71.44 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 74.21 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.427 HG21 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.596 ' HA ' HG21 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 75.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 73.43 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.659 HD12 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 72.0 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.596 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 71.4 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.509 ' HB2' HD12 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 73.12 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.558 ' HZ1' ' HB3' ' B' ' 140' ' ' LYS . 10.0 mtpm? . . . . . 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 75.24 111.583 172.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 112.803 0.668 . . . . 74.54 112.803 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 71.23 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ3' HD21 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 71.31 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 75.32 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 73.3 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 73.41 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 63.2 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 74.11 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.471 HD22 HD13 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 65.31 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.673 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.568 HG11 HD22 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 74.43 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.476 HD11 HD13 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 74.32 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.688 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 71.44 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 73.21 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.443 HD11 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 75.23 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HG2' HD21 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 72.34 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.608 ' NE2' HD11 ' A' ' 118' ' ' LEU . 18.1 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 73.5 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 74.05 114.036 173.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.412 HD21 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.13 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 73.44 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 71.22 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 75.24 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.411 ' H ' HD22 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 75.12 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 74.33 111.108 170.615 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt . . . . . 0 CA--C 1.564 1.5 0 N-CA-C 112.149 0.426 . . . . 74.04 112.149 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.587 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 74.15 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 73.02 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.673 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 75.31 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 74.01 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.539 HD23 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 75.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 75.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.443 HD21 HD11 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.55 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 75.13 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 73.13 110.983 172.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.409 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 74.4 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 63.43 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.55 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.5 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HG ' ' HE2' ' B' ' 120' ' ' MET . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 73.33 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.568 HD22 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.406 ' HA ' HG21 ' A' ' 94' ' ' VAL . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 75.11 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.45 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.447 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.21 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.447 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 74.24 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 70.44 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 75.33 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 74.42 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.697 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 73.42 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.458 HD13 HG22 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 73.04 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 71.02 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.697 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.43 HG22 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.449 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.25 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.608 HD11 ' NE2' ' A' ' 36' ' ' GLN . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.498 ' O ' HG12 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 74.41 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.456 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 73.21 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.541 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.541 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 71.34 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 75.22 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 64.04 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.523 HG11 HD12 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 72.12 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.459 ' HA ' HG23 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.5 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 74.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 64.41 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 73.53 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 74.31 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.462 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 74.42 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 75.54 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.493 ' NH2' HE22 ' B' ' 69' ' ' GLN . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 65.41 112.011 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 72.24 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.579 ' HA ' HD11 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.562 HG23 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.663 HG13 HD22 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 71.14 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.438 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 74.43 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.684 ' HD3' HG21 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.515 ' HB3' HD12 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 74.43 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.521 HG21 HD12 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 75.24 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 73.11 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 75.42 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.547 ' HG3' HD11 ' B' ' 118' ' ' LEU . 0.0 OUTLIER -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 62.15 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 63.12 112.851 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.662 HD22 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 74.31 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 73.13 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 64.35 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 62.11 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.662 ' HB3' HD22 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.585 HG21 HG22 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.515 HD12 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 74.22 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 74.1 109.492 161.208 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 27.2 pt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 65.13 113.562 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 74.3 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.48 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 75.42 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 72.2 110.943 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.529 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.684 HG21 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 74.41 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.585 HG22 HG21 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 74.34 111.009 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.462 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 65.33 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 74.35 110.693 177.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.445 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 74.34 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . 0.493 HE22 ' NH2' ' B' ' 18' ' ' ARG . 65.1 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 64.11 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.579 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 72.44 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 74.32 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 74.43 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 74.31 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.438 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.438 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 62.35 109.868 173.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 74.12 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.538 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 72.51 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 74.34 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.43 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 72.44 111.779 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.663 HD22 HG13 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 74.12 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 73.45 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.532 ' HZ3' ' HB3' ' B' ' 93' ' ' LYS . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 70.51 112.488 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.453 HG21 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 73.22 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.453 HG23 HG21 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 44.24 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.576 ' HZ2' ' HB1' ' B' ' 100' ' ' ALA . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 74.22 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 73.4 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.421 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 71.34 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . 0.576 ' HB1' ' HZ2' ' B' ' 97' ' ' LYS . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 55.23 111.305 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.449 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 74.45 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 73.44 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.427 ' HE2' ' HD2' ' B' ' 74' ' ' LYS . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.43 HD11 HG22 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 73.01 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 73.43 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 52.03 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 73.35 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 75.15 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.458 HG22 HD13 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 74.23 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 71.45 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.421 ' HE2' ' HG ' ' A' ' 85' ' ' LEU . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.644 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 74.31 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.448 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.644 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 75.12 109.48 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.407 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 61.43 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 71.44 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.47 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 74.21 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.444 HG21 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG23 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 75.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 73.43 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.523 HD12 HG11 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 72.0 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.615 HG23 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 71.4 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 73.12 108.331 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 75.24 111.784 178.502 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 112.102 0.408 . . . . 74.54 112.102 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 71.23 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 71.31 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 75.32 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 73.3 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 73.41 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' HG13 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 63.2 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 74.11 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.488 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 65.31 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 HD22 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 74.43 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.428 HD12 HD21 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 74.32 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.539 ' HA ' HD13 ' A' ' 40' ' ' LEU . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 71.44 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 73.21 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 75.23 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 72.34 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 73.5 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 74.05 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.737 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.13 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 73.44 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 71.22 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.607 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 75.24 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.737 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 75.12 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.445 HG21 HG21 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 74.33 109.12 166.904 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 120.237 0.065 . . . . 74.04 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.668 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 74.15 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 73.02 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.47 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 75.31 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 74.01 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.445 HG21 HG21 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 75.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.58 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 75.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.55 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 75.13 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 73.13 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.408 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.445 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 74.4 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.4 ' HA ' HD11 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 63.43 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.447 ' HB2' HD12 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.55 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.5 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.402 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 73.33 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.488 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 75.11 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.45 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.468 HG13 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.21 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.496 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 74.24 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 70.44 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 75.33 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.538 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 74.42 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 73.42 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 73.04 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.523 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 71.02 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.462 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.25 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 74.41 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 73.21 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.45 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.417 HG12 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 71.34 110.88 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 75.22 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 64.04 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 72.12 111.667 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.438 ' HA ' HG21 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.5 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 74.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.477 ' HB ' HD13 ' B' ' 133' ' ' LEU . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 64.41 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 73.53 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 74.31 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm . . . . . 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 . . . . . 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 74.42 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.533 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 75.54 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 65.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 72.24 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.545 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.731 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 71.14 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 74.43 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.723 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 74.43 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.445 HG22 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 75.24 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 73.11 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 75.42 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 62.15 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 63.12 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.47 HG11 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 74.31 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 73.13 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 64.35 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 62.11 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.588 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 74.22 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 74.1 108.84 163.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 65.13 112.273 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 74.3 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 75.42 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 72.2 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.723 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 74.41 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 74.34 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.43 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 65.33 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 74.35 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 74.34 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 64.11 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.47 ' HB3' HG11 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 72.44 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 74.32 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 74.43 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 74.31 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 62.35 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 74.12 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.407 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 72.51 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 74.34 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.651 ' HB3' HD22 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.43 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 72.44 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.731 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 74.12 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.508 ' HA ' HG23 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 73.45 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 70.51 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.508 HG23 ' HA ' ' B' ' 91' ' ' TYR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 73.22 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.505 HG21 HG22 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 44.24 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 74.22 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 73.4 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 71.34 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 55.23 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 74.45 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.522 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 73.44 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 73.01 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 73.43 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.42 ' HG3' HG22 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 52.03 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 73.35 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.413 HD22 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 75.15 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 74.23 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 71.45 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.522 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.548 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 74.31 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.548 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 75.12 109.811 177.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 61.43 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 71.44 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.519 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 74.21 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.564 ' HA ' HG21 ' B' ' 134' ' ' THR . 1.5 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 75.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.517 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 73.43 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 72.0 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.564 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 71.4 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 73.12 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.577 ' HB3' ' HZ3' ' B' ' 140' ' ' LYS . 8.4 mtpm? . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 75.24 111.892 178.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 CA--C 1.557 1.221 0 N-CA-C 112.215 0.45 . . . . 74.54 112.215 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 71.23 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 71.31 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 75.32 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 73.3 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 73.41 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HD2' HD11 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 63.2 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 74.11 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.572 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 65.31 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.437 HG23 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 74.43 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 74.32 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.496 HG22 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 71.44 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 73.21 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 75.23 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 72.34 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 73.5 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 74.05 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.13 110.476 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 73.44 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 71.22 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 75.24 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 75.12 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 74.33 112.87 174.191 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 74.04 114.142 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 74.15 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 73.02 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.519 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 75.31 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 74.01 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 75.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 75.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.55 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 75.13 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 73.13 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 74.4 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.476 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 63.43 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.572 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.55 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.5 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.414 ' HB3' HD22 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 73.33 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.408 ' HG3' HD23 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.437 HD21 HG12 ' A' ' 24' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 75.11 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.578 ' HB3' ' HZ1' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.45 112.862 177.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.448 HG22 ' HA ' ' A' ' 91' ' ' TYR . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.21 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 74.24 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 70.44 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 75.33 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 74.42 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 73.42 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 73.04 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 71.02 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 113' ' ' SER . 19.4 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.25 111.666 176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 74.41 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.532 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 73.21 113.021 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.552 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.552 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 71.34 110.155 178.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.592 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 75.22 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 64.04 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 72.12 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG23 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.5 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.519 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 74.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.562 HG23 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 64.41 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 73.53 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 74.31 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.444 ' HZ1' ' HB3' ' A' ' 140' ' ' LYS . 9.0 mtpm? . . . . . 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 74.42 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 75.54 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 65.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 72.24 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.457 HG22 HD12 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 71.14 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 74.43 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.587 ' HD3' HG21 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.422 ' HB3' HD13 ' B' ' 49' ' ' LEU . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 74.43 112.111 -170.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.559 HG23 HD13 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 75.24 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 HD13 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 73.11 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.548 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 75.42 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 62.15 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.576 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 63.12 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.813 HD23 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 74.31 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 73.13 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 64.35 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 62.11 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.813 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.6 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.517 HG22 HG22 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.422 HD13 ' HB3' ' B' ' 28' ' ' SER . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 74.22 111.779 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 74.1 112.968 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.429 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt . . . . . 0 CA--C 1.559 1.325 0 N-CA-C 112.7 0.63 . . . . 65.13 112.7 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.515 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 74.3 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.497 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 75.42 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.429 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 72.2 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.515 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.587 HG21 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 74.41 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.517 HG22 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 74.34 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 65.33 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.579 HG22 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 74.35 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.43 HD13 HD11 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 74.34 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 64.11 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.441 ' O ' HG21 ' B' ' 77' ' ' VAL . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 72.44 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.454 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 74.32 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 74.43 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 74.31 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.434 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.434 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 62.35 110.673 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 74.12 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.497 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.532 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 72.51 110.331 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 74.34 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.594 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.43 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.409 ' HG3' HD23 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 72.44 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.457 HD12 HG22 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 74.12 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.46 ' HA ' HG21 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 73.45 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.565 ' HZ1' ' HB3' ' B' ' 93' ' ' LYS . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 70.51 112.03 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.46 HG21 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 73.22 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.524 ' HB ' ' HZ3' ' B' ' 97' ' ' LYS . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 44.24 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.524 ' HZ3' ' HB ' ' B' ' 95' ' ' THR . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 74.22 111.611 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 73.4 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.423 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 71.34 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 55.23 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.497 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 74.45 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.485 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 73.44 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' SER . . . . . 0.411 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.519 HD11 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 73.01 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 73.43 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.576 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.519 ' HG3' HD11 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 52.03 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 73.35 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 75.15 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.416 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 74.23 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 71.45 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.428 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.48 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 74.31 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.48 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 75.12 110.151 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.592 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 61.43 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 71.44 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 74.21 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.45 HG21 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.608 ' HA ' HG23 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 75.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 73.43 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 72.0 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.608 HG23 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 71.4 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.534 ' HB2' HD12 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.443 HD12 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 73.12 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 47.8 tttm . . . . . 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 75.24 110.32 178.523 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 111.675 0.25 . . . . 74.54 111.675 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 71.23 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.512 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 71.31 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 75.32 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 73.3 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 73.41 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 63.2 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 74.11 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.518 HD22 HD13 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 65.31 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.574 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 74.43 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 74.32 110.644 -174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.577 ' HB3' HD23 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 71.44 113.816 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 73.21 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 75.23 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 72.34 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.441 ' HG3' HD13 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 73.5 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 74.05 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.412 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.13 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 73.44 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 71.22 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.574 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 75.24 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 75.12 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.516 HG21 HG22 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.445 HD13 ' HZ3' ' A' ' 60' ' ' LYS . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 74.33 112.879 179.19 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 42.0 pt . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 112.447 0.536 . . . . 74.04 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 74.15 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 73.02 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.576 HG21 ' HD3' ' A' ' 27' ' ' PRO . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 75.31 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 74.01 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.516 HG22 HG21 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 75.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 75.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.626 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.55 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 75.13 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 73.13 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG22 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.478 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 74.4 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 63.43 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.626 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.55 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.412 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.5 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.776 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.573 HD22 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.412 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.444 ' HB3' HD22 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 73.33 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.637 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.518 HD13 HD22 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 75.11 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.525 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.45 112.881 177.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.21 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 74.24 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 70.44 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.776 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 75.33 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.488 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.447 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.47 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 74.42 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 73.42 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.585 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 73.04 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.585 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 71.02 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.47 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.25 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.736 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 74.41 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 73.21 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.508 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.573 ' HG2' HD22 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.508 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 71.34 110.0 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.606 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 75.22 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 64.04 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 72.12 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.5 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 74.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 64.41 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.602 ' HB2' HD12 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 73.53 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 74.31 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.56 ' HZ2' ' HA ' ' A' ' 140' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.56 1.365 0 CA-C-O 121.052 0.454 . . . . 63.54 112.117 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.517 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 74.42 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' SER . . . . . 0.418 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.621 HD22 HD22 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 75.54 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.517 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 65.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 72.24 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.562 HD22 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.632 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.474 HG13 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 71.14 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 74.43 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.505 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 74.43 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.573 HG23 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 75.24 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.412 ' HB2' HD12 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 73.11 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 75.42 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.437 ' HB2' HD12 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 62.15 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 63.12 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.548 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 74.31 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 73.13 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 64.35 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.686 ' HB3' HG23 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 62.11 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.451 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.62 HG22 HG21 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.528 ' HA ' ' HZ3' ' B' ' 60' ' ' LYS . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 74.22 111.522 173.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 74.1 111.829 177.949 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.426 HD12 ' HD2' ' B' ' 59' ' ' ARG . 18.8 pt . . . . . 0 CA--C 1.564 1.502 0 N-CA-C 112.61 0.596 . . . . 65.13 112.61 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.644 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 74.3 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.442 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 75.42 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 72.2 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.632 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 74.41 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.62 HG21 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 74.34 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 65.33 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.686 HG23 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 74.35 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 74.34 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.675 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 64.11 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.675 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 72.44 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 74.32 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 74.43 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 74.31 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.621 HD22 HD22 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 62.35 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.415 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 74.12 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.492 HD22 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 72.51 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 74.34 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.567 ' HB3' HD22 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.43 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.43 ' HG3' HD23 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 72.44 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.567 HD22 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 74.12 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 73.45 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 70.51 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 73.22 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 44.24 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 74.22 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 73.4 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 71.34 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 55.23 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 74.45 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 73.44 113.062 177.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.454 HD13 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 73.01 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 73.43 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.454 ' HG2' HD13 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 52.03 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 73.35 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 75.15 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 74.23 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.437 HD12 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 71.45 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.736 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.634 ' SD ' HD22 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.426 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.492 ' HG2' HD22 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 74.31 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.497 HG23 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 75.12 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.606 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 61.43 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 71.44 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . 0.481 ' HZ3' ' HB2' ' B' ' 128' ' ' LYS . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 74.21 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.464 HG22 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.449 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 75.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.466 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 73.43 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 72.0 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.449 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 71.4 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.544 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 73.12 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.621 ' HZ2' ' HB3' ' B' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 75.24 111.073 175.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 112.853 0.686 . . . . 74.54 112.853 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 71.23 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 71.31 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 75.32 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 73.3 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.595 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 73.41 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.595 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 63.2 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 74.11 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HA ' HD11 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 65.31 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.561 HG23 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.598 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.514 HG13 HD23 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 74.43 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 74.32 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.518 ' HD3' HG23 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.614 HD13 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.606 HG23 HD12 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 71.44 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 73.21 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 75.23 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 72.34 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 73.5 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 74.05 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.606 HD12 HG23 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.13 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 73.44 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 71.22 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.6 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 75.24 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 75.12 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.634 ' NE2' HG11 ' A' ' 48' ' ' VAL . 1.5 pp0? -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.67 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 74.33 111.974 178.005 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 CA--C 1.562 1.436 0 N-CA-C 112.958 0.725 . . . . 74.04 112.958 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 74.15 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.67 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 73.02 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.561 ' HB ' HG23 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 75.31 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 74.01 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.509 HD11 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 75.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 75.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.55 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 75.13 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 73.13 111.107 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.447 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 74.4 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 63.43 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.55 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.5 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 73.33 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 HG13 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.471 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 75.11 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.45 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.52 HG21 HG22 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.21 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.52 HG22 HG21 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 74.24 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.522 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.608 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 70.44 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 75.33 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.427 ' O ' HD11 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.633 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 74.42 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 73.42 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.668 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 73.04 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.668 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 71.02 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.411 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.25 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.687 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 74.41 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 73.21 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.542 ' HA ' ' HE3' ' A' ' 124' ' ' MET . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 121' ' ' THR . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 71.34 110.108 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 75.22 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 64.04 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.529 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 72.12 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.622 ' HA ' HG23 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.5 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 74.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.622 HG23 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 64.41 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.711 ' HB2' HD12 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 73.53 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 74.31 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.469 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 74.42 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.575 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 75.54 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.575 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 65.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 72.24 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.412 HG11 HD23 ' B' ' 90' ' ' LEU . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 71.14 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.645 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 74.43 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.805 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 74.43 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.491 HG21 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 75.24 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 73.11 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 75.42 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 62.15 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 63.12 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.518 ' HB ' HG23 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.555 HD23 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 74.31 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 73.13 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 64.35 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.483 ' O ' HG23 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 62.11 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.555 ' HB3' HD23 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.433 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 74.22 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 74.1 112.643 -176.176 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 37.9 pt . . . . . 0 CA--C 1.554 1.11 0 N-CA-C 112.634 0.605 . . . . 65.13 112.634 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.516 ' O ' HG21 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 74.3 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 75.42 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 72.2 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.474 ' HE2' ' HA ' ' B' ' 48' ' ' VAL . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.805 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 74.41 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.425 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.48 ' HB2' HG13 ' B' ' 48' ' ' VAL . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 74.34 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 65.33 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 74.35 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 74.34 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.518 HG23 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 64.11 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 72.44 111.524 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 74.32 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 74.43 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 74.31 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.441 ' O ' HD12 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.417 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . 0.508 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 62.35 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.645 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 74.12 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.508 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 72.51 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 74.34 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.477 ' HB3' HD21 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.43 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 72.44 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 74.12 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 73.45 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.418 ' HD3' HD12 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 70.51 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.431 HG11 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 73.22 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 44.24 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 74.22 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 73.4 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.534 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 71.34 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 55.23 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 74.45 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.468 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 73.44 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.546 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 73.01 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 73.43 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 52.03 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 73.35 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.546 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 75.15 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 74.23 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 71.45 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.687 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.676 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 74.31 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.676 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 75.12 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 61.43 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 71.44 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . 0.569 ' HA ' HE21 ' B' ' 131' ' ' GLN . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 74.21 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.408 HG21 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.569 HE21 ' HA ' ' B' ' 128' ' ' LYS . 27.5 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 75.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 73.43 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 72.0 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.504 HG23 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 71.4 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.711 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 73.12 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.469 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm . . . . . 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 75.24 112.524 -170.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 CA--C 1.554 1.131 0 CA-C-O 120.145 0.021 . . . . 74.54 111.01 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 71.23 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 71.31 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 75.32 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 73.3 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 73.41 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 63.2 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 74.11 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 65.31 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.58 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 74.43 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 74.32 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.715 ' HD3' HG22 ' A' ' 61' ' ' VAL . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.7 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.614 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 71.44 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.404 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 73.21 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.413 HD13 HD12 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 75.23 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 72.34 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 73.5 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HG ' ' HB ' ' A' ' 106' ' ' ILE . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 74.05 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.534 HG11 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.614 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.13 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 73.44 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 71.22 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 75.24 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.457 ' HB3' HD23 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 75.12 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 74.33 110.487 165.946 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.569 0.581 . . . . 74.04 112.569 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.671 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.534 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 74.15 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 73.02 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.715 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 75.31 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 74.01 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.418 HG21 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.413 HD12 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 75.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 75.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.55 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 75.13 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 73.13 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.451 ' O ' HG23 ' A' ' 77' ' ' VAL . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG2' HG11 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 74.4 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 63.43 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.55 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . 0.402 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.5 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.402 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' HD22 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 73.33 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 75.11 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.475 ' HD3' HD12 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.45 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.21 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 74.24 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 70.44 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 75.33 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.437 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 74.42 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.468 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 73.42 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 73.04 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' HB ' ' A' ' 116' ' ' THR . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 71.02 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.468 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 113' ' ' SER . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.25 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 74.41 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.467 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 73.21 111.831 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.409 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 71.34 110.24 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 75.22 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 64.04 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 72.12 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.584 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.2 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.5 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 74.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.584 HG21 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 64.41 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.604 ' HB2' HD12 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 73.53 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 74.31 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 74.42 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 75.54 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 65.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.556 HG23 ' HZ2' ' B' ' 93' ' ' LYS . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 72.24 111.104 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.611 HD23 HD11 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.463 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.728 HG13 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 71.14 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 74.43 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.549 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 74.43 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD11 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 75.24 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.435 HD11 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 73.11 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 75.42 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.413 ' HG3' HD22 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 62.15 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.585 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 63.12 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.461 HD13 HD23 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 74.31 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 73.13 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 64.35 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 62.11 111.912 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 74.22 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 74.1 109.525 168.652 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.534 HD11 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 65.13 113.61 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.455 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 74.3 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 75.42 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 72.2 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.549 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.476 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 74.41 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 74.34 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 65.33 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 74.35 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.461 HD23 HD13 ' B' ' 40' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 74.34 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 64.11 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 72.44 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 74.32 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 74.43 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 74.31 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 62.35 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 74.12 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.467 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 72.51 110.463 176.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 74.34 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.548 ' HB3' HD22 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . 0.461 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.43 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.563 ' HG3' HD23 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 72.44 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.728 HD21 HG13 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 74.12 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.499 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 73.45 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.556 ' HZ2' HG23 ' B' ' 20' ' ' THR . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 70.51 112.842 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 73.22 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 44.24 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 74.22 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 73.4 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.499 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 71.34 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 55.23 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 74.45 110.858 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 73.44 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.445 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 73.01 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 73.43 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.585 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 52.03 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 73.35 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.445 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 75.15 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 74.23 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.413 HD22 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 71.45 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.501 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.598 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 74.31 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.501 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.598 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 75.12 110.736 -176.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 61.43 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 71.44 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 74.21 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.509 HG22 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG21 ' B' ' 134' ' ' THR . 2.6 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 75.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 73.43 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 72.0 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.604 HG21 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 71.4 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.604 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 73.12 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.54 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? . . . . . 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 75.24 111.46 -174.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 112.6 0.593 . . . . 74.54 112.6 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 71.23 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.482 ' HZ3' HD21 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 71.31 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.514 ' HB ' ' HH ' ' A' ' 76' ' ' TYR . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 75.32 111.022 172.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 73.3 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 73.41 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.524 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 63.2 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 74.11 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 65.31 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.539 HG13 HD23 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 74.43 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.522 HD12 HD21 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 74.32 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.732 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.47 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 71.44 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 73.21 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.453 HD13 HD12 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 75.23 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 72.34 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 118' ' ' LEU . 14.9 mm100 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 73.5 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 74.05 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.13 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 73.44 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . 0.435 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 71.22 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 75.24 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 75.12 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 74.33 112.798 -175.961 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.564 1.499 0 N-CA-C 113.556 0.947 . . . . 74.04 113.556 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 74.15 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 73.02 111.433 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.732 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 75.31 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 74.01 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.453 HD12 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.482 HD21 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 75.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.431 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 75.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.55 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 75.13 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 73.13 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.514 ' HH ' ' HB ' ' A' ' 13' ' ' VAL . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 74.4 112.706 171.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' HD11 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 63.43 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.492 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.55 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.5 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.611 ' HB3' HD21 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 73.33 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 75.11 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.45 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.21 112.618 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.639 ' HB ' ' HZ3' ' A' ' 97' ' ' LYS . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 74.24 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.639 ' HZ3' ' HB ' ' A' ' 95' ' ' THR . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 70.44 109.869 162.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 75.33 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.492 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 74.42 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 73.42 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 73.04 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 71.02 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.25 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 74.41 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 73.21 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.467 ' HA ' ' HE1' ' A' ' 124' ' ' MET . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.467 ' HE1' ' HA ' ' A' ' 121' ' ' THR . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 71.34 110.552 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.762 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 75.22 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.487 ' HZ1' ' HB2' ' A' ' 128' ' ' LYS . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 64.04 110.931 173.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 72.12 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.478 ' HA ' HG23 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.5 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 74.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.478 HG23 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 64.41 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 73.53 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 74.31 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 74.42 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.489 HD23 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 75.54 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.468 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 65.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 72.24 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.587 HD21 HD11 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.472 HG13 HD23 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 71.14 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 74.43 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.581 ' HB3' HD23 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 74.43 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.449 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 75.24 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 73.11 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 75.42 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 62.15 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 63.12 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.665 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 74.31 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 73.13 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 64.35 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 62.11 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.665 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 74.22 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 74.1 111.769 170.774 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 112.352 0.501 . . . . 65.13 112.352 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 74.3 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 75.42 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 72.2 111.94 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.453 ' HB3' HG12 ' B' ' 48' ' ' VAL . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.486 HG23 ' HD3' ' B' ' 27' ' ' PRO . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 74.41 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 74.34 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 65.33 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 74.35 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 74.34 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 64.11 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.598 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 72.44 111.448 176.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 74.32 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.46 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 74.43 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 74.31 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.489 HD21 HD23 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 62.35 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 74.12 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 72.51 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 74.34 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.401 ' HB3' HD21 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.43 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 72.44 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.587 HD11 HD21 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 74.12 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 73.45 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.578 ' HB2' ' HZ1' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 70.51 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.446 HG12 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 73.22 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 44.24 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 74.22 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 73.4 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 71.34 113.251 170.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 55.23 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 74.45 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.445 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 73.44 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.598 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.445 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 73.01 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 73.43 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.408 ' HG3' HG21 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 52.03 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 73.35 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 75.15 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 74.23 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 71.45 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.461 ' O ' HG21 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.544 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 74.31 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.461 HG21 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.544 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 75.12 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.762 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 61.43 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 71.44 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.469 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 74.21 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.43 HG22 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.558 ' HA ' HG23 ' B' ' 134' ' ' THR . 22.7 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 75.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 73.43 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 72.0 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.558 HG23 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 71.4 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.567 ' HB2' HD12 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.494 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 73.12 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm . . . . . 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 75.24 111.565 -171.921 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 CA--C 1.562 1.433 0 N-CA-C 113.655 0.983 . . . . 74.54 113.655 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 71.23 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 71.31 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 75.32 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 73.3 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 73.41 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 74.11 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 65.31 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.687 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.65 HG13 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 74.43 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 74.32 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.548 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 71.44 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 73.21 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 75.23 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 72.34 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 73.5 112.002 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 74.05 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.526 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.13 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 73.44 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 71.22 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.412 ' HB2' ' HG ' ' A' ' 40' ' ' LEU . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 75.24 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.423 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 75.12 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.677 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 74.33 110.885 171.771 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 74.04 113.108 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 74.15 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.677 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 73.02 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.426 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 75.31 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 74.01 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 75.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 75.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.55 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 75.13 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 73.13 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 74.4 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 63.43 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.562 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.55 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.5 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' HD22 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 73.33 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.45 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.521 ' HG3' HD23 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.65 HD21 HG13 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.562 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.58 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 75.11 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.466 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.45 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.21 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 74.24 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.58 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 70.44 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.4 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 75.33 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.509 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 74.42 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 73.42 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 112' ' ' GLU . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 73.04 112.614 -176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.523 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 71.02 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.25 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 74.41 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.472 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 73.21 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 71.34 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 75.22 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.41 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 64.04 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.474 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.403 HG21 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 72.12 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG23 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.5 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 74.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.604 HG23 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 64.41 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 73.53 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.587 HD13 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 74.31 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.764 0.653 . . . . 63.54 112.764 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 74.42 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.414 HD22 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 75.54 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.428 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 65.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 72.24 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.485 HD22 HD11 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.514 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.768 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.458 HG13 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 71.14 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.438 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 74.43 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.587 ' HD3' HG21 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.497 ' HB2' HD13 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 74.43 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.545 ' HA ' HD13 ' B' ' 40' ' ' LEU . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 75.24 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 73.11 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 75.42 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 62.15 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' HB2' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 63.12 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.545 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 74.31 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 73.13 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . 0.405 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 64.35 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.5 ' O ' HG23 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 62.11 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.401 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.618 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 74.22 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 74.1 112.372 178.628 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 65.13 113.518 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.488 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 74.3 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.768 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 75.42 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 72.2 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.618 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.587 HG21 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 74.41 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.409 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 74.34 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 65.33 110.339 174.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . 0.581 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 74.35 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 74.34 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 64.11 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 72.44 111.101 174.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.423 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 74.32 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 74.43 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 74.31 112.639 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.51 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.51 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 62.35 109.3 173.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 74.12 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 72.51 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 74.34 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.452 ' HB3' HD22 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.43 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD23 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 72.44 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.555 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 74.12 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 73.45 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.616 ' HZ3' ' HB2' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 70.51 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.481 HG23 HG22 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 73.22 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.481 HG22 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 44.24 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 74.22 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 73.4 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 71.34 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 55.23 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 74.45 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.442 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 73.44 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 73.01 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 73.43 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.492 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 52.03 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.447 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 73.35 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 75.15 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 74.23 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.433 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 71.45 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.567 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 74.31 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 75.12 110.958 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 61.43 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 71.44 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 74.21 111.314 173.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG23 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 75.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 73.43 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 72.0 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 71.4 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.587 ' HB2' HD13 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 73.12 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 75.24 111.538 -176.152 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 111.638 0.236 . . . . 74.54 111.638 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 71.23 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 71.31 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 75.32 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 73.3 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 73.41 112.893 -177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.532 ' HG2' HD11 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 63.2 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 74.11 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 65.31 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.486 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 74.43 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.47 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 74.32 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.706 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.51 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.53 HG22 HD12 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 71.44 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 73.21 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.459 HD11 HD22 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 75.23 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 72.34 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.419 ' HG3' HD13 ' A' ' 118' ' ' LEU . 14.3 mm100 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 73.5 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.511 ' HG2' ' HB2' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 74.05 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.49 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.13 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 73.44 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 71.22 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 75.24 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 75.12 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 74.33 111.049 176.017 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.751 0.278 . . . . 74.04 111.751 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.706 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.486 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 74.15 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.557 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 73.02 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.51 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 75.31 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 74.01 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.419 HD11 HD11 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 75.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 75.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.459 HD22 HD11 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.55 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 75.13 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 73.13 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.49 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 74.4 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 63.43 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.55 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.5 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.587 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.414 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.408 ' HB3' HD21 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 73.33 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.609 HD12 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 75.11 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.609 ' HD3' HD12 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.45 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.21 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 74.24 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 70.44 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.587 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 75.33 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.403 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.482 ' HE3' ' HD2' ' A' ' 74' ' ' LYS . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 74.42 111.233 176.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 73.42 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.502 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.511 ' HB2' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 73.04 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.502 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 71.02 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.25 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.419 HD13 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 74.41 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.412 ' HA ' ' HE3' ' A' ' 120' ' ' MET . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 73.21 113.039 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.502 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.451 HG11 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.502 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 71.34 110.63 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.451 ' NE2' HD22 ' B' ' 126' ' ' LEU . 9.7 tp-100 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 75.22 111.321 176.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 64.04 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 72.12 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG21 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.5 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 74.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.542 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.494 HG21 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 64.41 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD13 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 73.53 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 74.31 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 137' ' ' LEU . 63.9 tttm . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . 0.469 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 74.42 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.433 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 75.54 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.433 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 65.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 72.24 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.555 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.426 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.563 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.672 HG11 HD23 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 71.14 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.495 HD12 HD12 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 74.43 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' SER . . . . . 0.518 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 74.43 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.473 HG22 HD12 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 75.24 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 73.11 112.113 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 75.42 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 62.15 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 63.12 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.473 HD12 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 74.31 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 73.13 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 64.35 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 62.11 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.518 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 74.22 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 74.1 111.064 173.113 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.56 1.353 0 CA-C-O 121.364 0.602 . . . . 65.13 111.175 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 74.3 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.563 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 75.42 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 72.2 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.574 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 74.41 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.468 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 74.34 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.469 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 65.33 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.468 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 74.35 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.426 HD21 HD11 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 74.34 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 64.11 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.57 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 72.44 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.4 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 74.32 111.565 173.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 74.43 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 74.31 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 62.35 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.495 HD12 HD12 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 74.12 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 72.51 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 74.34 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD21 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.43 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 72.44 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.672 HD23 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 74.12 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.487 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 73.45 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 70.51 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.438 HG12 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 73.22 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 44.24 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 74.22 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.481 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 73.4 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.487 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 71.34 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 55.23 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 74.45 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.635 ' HD2' HD22 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 73.44 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.412 HG22 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.587 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 73.01 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 73.43 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 110' ' ' SER . . . . . 0.42 ' HG ' ' HA3' ' B' ' 114' ' ' GLY . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . 0.587 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 52.03 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 73.35 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . 0.42 ' HA3' ' HG ' ' B' ' 110' ' ' SER . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.635 HD22 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 75.15 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 74.23 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 71.45 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.565 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.425 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 74.31 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.51 HG21 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.425 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 75.12 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 61.43 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 71.44 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.4 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 74.21 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.428 HG21 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.703 ' HA ' HG21 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 75.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 73.43 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.703 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 71.4 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.544 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 73.12 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 75.24 112.892 171.402 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 71.23 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 71.31 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 75.32 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.458 HD22 HD23 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 73.3 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 73.41 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 63.2 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.597 HG23 ' HZ1' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 74.11 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HA ' HD11 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 65.31 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.738 HG12 HD22 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 74.43 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.534 HD13 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 74.32 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.723 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.521 ' HG3' HG21 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.551 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 71.44 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 73.21 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 75.23 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 72.34 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.465 ' HB2' HD13 ' A' ' 118' ' ' LEU . 14.6 mm100 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 73.5 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.404 ' HG ' ' HB ' ' A' ' 106' ' ' ILE . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 74.05 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.509 HG11 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.551 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.13 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 73.44 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 71.22 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' HG12 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 75.24 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 75.12 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 74.33 111.281 172.494 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 CA--C 1.554 1.132 0 CA-C-O 121.286 0.565 . . . . 74.04 111.625 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.571 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 74.15 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.546 ' HG3' HG12 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 73.02 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.651 HG21 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 75.31 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 74.01 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 75.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.413 HG12 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 75.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.55 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 75.13 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 73.13 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.509 ' HB3' HG11 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 74.4 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 63.43 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.526 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.55 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.5 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.499 ' HA ' ' HE3' ' B' ' 120' ' ' MET . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 73.33 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.477 ' HG3' HD21 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.738 HD22 HG12 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.41 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.634 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 75.11 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.597 ' HZ1' HG23 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.45 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.21 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 74.24 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.634 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 70.44 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 75.33 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.467 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 74.42 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.445 HG23 HD11 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 73.42 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 73.04 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 71.02 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.445 HD11 HG23 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.25 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.629 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 74.41 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.489 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 73.21 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.609 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.609 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 71.34 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 75.22 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 64.04 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.54 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 72.12 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.685 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.5 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 74.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.685 HG21 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 64.41 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.569 ' HB2' HD12 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 73.53 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 74.31 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.559 ' HE2' HD22 ' B' ' 137' ' ' LEU . 91.6 mttt . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 74.42 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.421 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 75.54 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 65.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 72.24 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.473 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' SER . . . . . 0.433 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 71.14 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 74.43 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.659 ' HD3' HG23 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 74.43 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.422 HD11 HD22 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.572 HG22 HD13 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 75.24 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 73.11 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 75.42 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 62.15 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.501 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 63.12 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.417 HG11 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.572 HD13 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 74.31 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 73.13 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 64.35 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.446 ' HA ' ' HG2' ' B' ' 47' ' ' GLN . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 62.11 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.446 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.446 HG22 HD21 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.446 HD21 HG22 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 74.22 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 74.1 110.957 178.801 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.9 pp . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.95 0.405 . . . . 65.13 111.651 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 74.3 115.34 -172.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.473 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 75.42 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 72.2 110.721 173.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.519 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.659 HG23 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 74.41 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.432 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 74.34 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 65.33 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.523 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 74.35 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 74.34 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.523 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 64.11 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.471 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 72.44 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 74.32 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 74.43 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 74.31 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 62.35 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 74.12 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.489 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 72.51 111.046 176.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 74.34 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.43 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 72.44 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 74.12 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 73.45 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 70.51 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.504 HG21 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 73.22 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.504 HG23 HG21 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 44.24 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 74.22 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 73.4 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 71.34 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 55.23 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.433 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 74.45 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.402 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 73.44 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.471 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.535 HG21 HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 73.01 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 73.43 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.501 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 52.03 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 73.35 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.535 HD11 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 75.15 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 74.23 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 71.45 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.629 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.499 ' HE3' ' HA ' ' A' ' 85' ' ' LEU . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.425 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 74.31 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.444 HG11 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 75.12 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 61.43 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 71.44 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 74.21 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.466 HG11 HD13 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.527 ' HA ' HG21 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 75.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 73.43 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 72.0 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.527 HG21 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 71.4 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.12 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.466 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt . . . . . 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 75.24 111.079 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.554 1.104 0 N-CA-C 111.99 0.367 . . . . 74.54 111.99 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 71.23 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.424 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 71.31 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 75.32 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 73.3 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 73.41 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 63.2 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 74.11 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 65.31 111.319 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.704 HG13 HD22 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 74.43 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.56 HD12 HD12 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 74.32 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.552 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.442 ' HB3' HD13 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.558 HG23 HD12 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 71.44 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 73.21 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 75.23 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 72.34 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.502 ' HB3' HD12 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 73.5 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 74.05 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.558 HD12 HG23 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.13 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 73.44 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 71.22 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 75.24 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 75.12 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.552 HG23 HG22 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.701 HD11 ' HZ3' ' A' ' 60' ' ' LYS . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 74.33 112.92 179.158 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 40.6 pt . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 74.04 113.614 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 74.15 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.701 ' HZ3' HD11 ' A' ' 49' ' ' LEU . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 73.02 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.552 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 75.31 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 74.01 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.441 HD13 ' HG3' ' A' ' 18' ' ' ARG . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 75.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 75.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.55 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 75.13 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 73.13 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.482 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 74.4 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 63.43 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.482 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.55 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.56 HD12 HD12 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.5 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 73.33 111.533 -177.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.704 HD22 HG13 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.491 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 75.11 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.45 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.21 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.59 ' HB ' ' HZ1' ' A' ' 97' ' ' LYS . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 74.24 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.59 ' HZ1' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 70.44 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 75.33 121.139 -164.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.488 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 74.42 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.502 HD12 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 73.42 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 73.04 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 71.02 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.25 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.53 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 74.41 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.495 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 73.21 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.504 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.504 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 71.34 109.694 -176.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 75.22 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 64.04 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 72.12 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.566 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.8 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.5 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 74.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.566 HG21 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 64.41 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.578 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 73.53 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 74.31 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.608 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 9.5 mtpm? . . . . . 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 74.42 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 75.54 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 65.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.529 HG23 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 72.24 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.654 HG11 HD22 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 71.14 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 74.43 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.723 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 74.43 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.466 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 75.24 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 73.11 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 75.42 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 62.15 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 63.12 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 74.31 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . 0.42 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 8.7 m-80 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 73.13 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . 0.467 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 64.35 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 62.11 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.424 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 74.22 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 74.1 112.448 179.588 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 CA--C 1.559 1.315 0 N-CA-C 111.927 0.343 . . . . 65.13 111.927 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 74.3 112.83 -172.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 75.42 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 72.2 111.528 174.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.723 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.494 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 74.41 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.4 HD21 ' HB3' ' B' ' 27' ' ' PRO . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 74.34 111.956 179.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 65.33 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.413 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 74.35 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 74.34 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 64.11 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.438 ' O ' HG22 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 72.44 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.416 ' CZ ' HD13 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 74.32 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.438 HG22 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 74.43 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 74.31 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.508 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 62.35 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 74.12 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 72.51 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 74.34 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.496 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.43 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 72.44 111.299 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.654 HD22 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 74.12 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.508 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 73.45 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.529 ' NZ ' HG23 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 70.51 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.44 HG23 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 73.22 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.413 HG23 HG22 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 44.24 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 74.22 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 73.4 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.496 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 71.34 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 55.23 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 74.45 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.403 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 73.44 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 73.01 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 73.43 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 52.03 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 73.35 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 75.15 111.874 178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 74.23 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 71.45 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.53 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.464 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.492 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 74.31 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.481 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 75.12 110.475 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 61.43 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 71.44 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 74.21 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.47 HG21 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.714 ' HA ' HG21 ' B' ' 134' ' ' THR . 1.4 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 75.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 73.43 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 72.0 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.714 HG21 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 71.4 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.578 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 73.12 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.544 ' HB3' ' HZ3' ' B' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 75.24 110.896 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.448 ' HB3' ' NE2' ' A' ' 69' ' ' GLN . 4.8 p-10 . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 71.23 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.441 ' HZ3' HD23 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 71.31 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 75.32 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 73.3 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 73.41 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.591 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 63.2 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.458 HG22 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 74.11 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.439 HD11 HG13 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 65.31 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.67 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 74.43 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 74.32 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.62 HG21 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 71.44 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 73.21 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 75.23 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 72.34 111.216 170.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 73.5 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 74.05 112.85 172.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG21 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.13 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 73.44 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 71.22 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 75.24 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.609 ' HB3' HD23 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 75.12 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 9.9 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 74.33 109.531 170.94 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 112.27 0.471 . . . . 74.04 112.27 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.404 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.466 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 74.15 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 73.02 112.634 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 75.31 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 74.01 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.621 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 75.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 75.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.55 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 8' ' ' ASP . 53.2 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 75.13 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 73.13 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . 0.444 ' O ' HG22 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.515 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 74.4 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.444 HG22 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 63.43 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.55 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.5 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 73.33 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD23 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.67 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.626 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 75.11 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.463 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.45 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.591 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.21 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.444 ' OG1' ' HG2' ' A' ' 97' ' ' LYS . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 74.24 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.568 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 70.44 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.465 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 75.33 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 74.42 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 73.42 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 73.04 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.432 ' HA ' HD13 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 71.02 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.25 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.639 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 74.41 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG21 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 73.21 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.6 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.6 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 71.34 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.586 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 75.22 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 64.04 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 72.12 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.5 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 74.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 64.41 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 73.53 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 74.31 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . 0.429 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 74.42 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.42 HD23 HD22 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 75.54 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 65.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.468 HG23 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 72.24 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.665 HD23 HD13 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.55 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.484 HG12 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 71.14 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 74.43 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.626 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 74.43 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.484 HG21 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 75.24 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 73.11 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 75.42 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.648 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 62.15 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.608 ' HG2' ' HB2' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 63.12 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.489 HG13 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.484 HD11 HG21 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 74.31 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 73.13 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 64.35 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 62.11 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.447 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.583 HG23 HG21 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.532 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 74.22 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 74.1 108.913 163.513 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 65.13 112.715 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 74.3 113.312 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.55 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 75.42 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 72.2 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.626 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.51 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 74.41 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.583 HG21 HG23 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 74.34 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 65.33 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 74.35 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 74.34 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 64.11 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.489 ' HB3' HG13 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 72.44 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 74.32 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 74.43 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 74.31 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . 0.507 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 62.35 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 74.12 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.532 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 72.51 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 74.34 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.573 ' HB3' HD22 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.43 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 72.44 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.665 HD13 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 74.12 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.465 ' HA ' HG21 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 73.45 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.55 ' HB3' ' HZ2' ' B' ' 93' ' ' LYS . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 70.51 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.465 HG21 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 73.22 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 44.24 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 74.22 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 73.4 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.445 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 71.34 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 55.23 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 74.45 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.532 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 73.44 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.489 HG22 HD12 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 73.01 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 73.43 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.608 ' HB2' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 52.03 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 73.35 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.489 HD12 HG22 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 75.15 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 116' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 74.23 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 71.45 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.58 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 74.31 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 75.12 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.586 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 61.43 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 71.44 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 74.21 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.48 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 75.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 73.43 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 72.0 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.48 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 71.4 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.554 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.57 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 73.12 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 75.24 112.615 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 . . . . . 0 CA--C 1.555 1.165 0 N-CA-C 111.766 0.284 . . . . 74.54 111.766 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 71.23 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 71.31 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 75.32 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 73.3 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 73.41 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.418 ' HA ' HD11 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 63.2 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 74.11 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.588 HD22 HD13 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 65.31 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.481 ' HB2' ' HZ1' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 74.43 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 74.32 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.642 ' HB3' HD23 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.481 HG21 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 71.44 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.433 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 73.21 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 75.23 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 72.34 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 12.8 mm100 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 73.5 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 74.05 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.13 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 73.44 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 71.22 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 75.24 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 75.12 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.577 HG22 HG11 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 74.33 111.406 174.247 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 74.04 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.63 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 74.15 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 73.02 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 75.31 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 74.01 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.577 HG11 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.642 HD23 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 75.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 75.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.55 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 75.13 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 73.13 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.442 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 74.4 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 63.43 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.55 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.596 HD12 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.5 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 122' ' ' GLU . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.609 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 73.33 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.609 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 75.11 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD12 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.45 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.562 HG22 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.21 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.562 HG23 HG22 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 74.24 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 70.44 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.519 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 75.33 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.519 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.509 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 74.42 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.487 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 73.42 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.648 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 73.04 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.648 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.42 ' HA ' ' HB ' ' A' ' 116' ' ' THR . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 71.02 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.487 ' HB2' HD13 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.25 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 74.41 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.464 ' O ' HG23 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 73.21 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.401 ' HG2' HD22 ' A' ' 85' ' ' LEU . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.538 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 71.34 109.955 177.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 75.22 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 64.04 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.448 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 72.12 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.456 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.5 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.47 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 74.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.456 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 64.41 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 73.53 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 74.31 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 113.293 0.849 . . . . 63.54 113.293 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 74.42 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 75.54 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 65.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 72.24 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.526 HG23 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.602 HG11 HD22 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 71.14 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 74.43 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.481 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 74.43 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.502 HH11 ' HB3' ' B' ' 86' ' ' TYR . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.487 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.479 HG23 HD12 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 75.24 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 HD22 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 73.11 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 75.42 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.445 ' HG3' HD13 ' B' ' 118' ' ' LEU . 12.7 mm100 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 62.15 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 63.12 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . 0.482 HG13 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.607 HD11 HD12 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 74.31 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 73.13 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 64.35 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 62.11 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.554 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 74.22 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 74.1 112.452 170.212 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 112.134 0.42 . . . . 65.13 112.134 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.412 ' O ' HG22 ' B' ' 61' ' ' VAL . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 74.3 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.48 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 75.42 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 72.2 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.481 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.526 ' HB ' HG23 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 74.41 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . 0.607 HD12 HD11 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 74.34 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 65.33 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 74.35 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.478 HD22 HD12 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 74.34 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.576 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 64.11 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.576 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 72.44 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 74.32 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 74.43 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 74.31 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . 0.508 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' SER . . . . . 0.508 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 62.35 110.737 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 74.12 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.439 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 72.51 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . 0.502 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 74.34 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.466 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.43 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 72.44 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.602 HD22 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 74.12 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.593 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 73.45 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.575 ' HD3' HD12 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 70.51 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 73.22 112.309 174.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 44.24 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 74.22 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 73.4 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.593 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 71.34 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 55.23 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . 0.439 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 74.45 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 73.44 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.457 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 73.01 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 73.43 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.569 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 52.03 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 73.35 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 75.15 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 74.23 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.445 HD13 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 71.45 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.58 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 74.31 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 75.12 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 61.43 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 71.44 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 74.21 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.46 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 75.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.484 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 73.43 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 72.0 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.46 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 71.4 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.524 ' HB2' HD13 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 73.12 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 75.24 110.647 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.472 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.594 0.235 . . . . 74.54 111.412 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 71.23 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.487 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 71.31 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 75.32 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 73.3 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 73.41 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 0.423 ' HB2' HG13 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 63.2 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.455 HG23 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 74.11 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.485 HD21 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 65.31 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.722 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.542 HG13 HD23 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 74.43 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 74.32 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.468 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.488 HG23 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 71.44 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 73.21 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 75.23 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 72.34 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 73.5 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 74.05 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.488 HD11 HG23 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.13 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 73.44 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 71.22 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.565 ' HA ' HE21 ' A' ' 47' ' ' GLN . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 75.24 112.043 -174.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 75.12 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.612 HE22 HD13 ' A' ' 67' ' ' ILE . 4.6 pp0? -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 74.33 109.856 179.047 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 74.04 113.224 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.722 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 74.15 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 73.02 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 75.31 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 74.01 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.487 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 75.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.612 HD13 HE22 ' A' ' 47' ' ' GLN . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 75.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.55 111.411 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . 0.472 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 75.13 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 73.13 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.638 ' HG3' ' HE3' ' A' ' 105' ' ' MET . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 74.4 110.751 169.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.601 ' HA ' HD13 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 63.43 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.55 110.851 171.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.5 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.544 ' HG ' HG23 ' B' ' 123' ' ' VAL . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.559 ' HB3' HD21 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 73.33 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.559 HD21 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.522 ' HH ' HG22 ' A' ' 102' ' ' VAL . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . 0.611 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 75.11 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.491 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.45 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.62 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.21 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 74.24 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.611 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 70.44 112.301 167.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 ' HH ' ' A' ' 91' ' ' TYR . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 75.33 111.919 -169.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.521 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.638 ' HE3' ' HG3' ' A' ' 74' ' ' LYS . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 74.42 110.988 176.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.405 ' O ' HD12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 73.42 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 73.04 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.442 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 71.02 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.25 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.719 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 74.41 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.585 ' HE3' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 73.21 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.568 ' HA ' ' HE1' ' A' ' 124' ' ' MET . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.568 ' HE1' ' HA ' ' A' ' 121' ' ' THR . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 71.34 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.598 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 75.22 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 124' ' ' MET . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 64.04 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.48 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 72.12 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.5 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 74.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 64.41 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.633 ' HB2' HD13 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 73.53 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 74.31 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 74.42 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.601 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 75.54 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.495 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.601 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 65.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.408 HG21 ' HZ1' ' B' ' 93' ' ' LYS . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 72.24 110.364 174.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.52 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.671 HG23 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.488 HG13 HD23 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 71.14 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.558 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 74.43 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 74.43 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.479 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 75.24 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 73.11 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 75.42 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.551 ' HG3' HD21 ' B' ' 118' ' ' LEU . 16.8 mm100 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 62.15 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.545 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 63.12 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.479 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 74.31 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 73.13 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 64.35 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.648 ' HA ' HE21 ' B' ' 47' ' ' GLN . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 62.11 111.768 -173.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.465 ' HB3' HD23 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . 0.648 HE21 ' HA ' ' B' ' 44' ' ' ASP . 4.5 pp0? -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . 0.434 HG23 HG22 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 74.22 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 74.1 112.761 178.345 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.94 0.348 . . . . 65.13 111.94 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 74.3 113.376 -176.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 75.42 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 72.2 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.604 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.671 ' HB ' HG23 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 74.41 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . 0.434 HG22 HG23 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 74.34 111.048 172.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 65.33 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 74.35 111.58 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 74.34 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 64.11 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . 0.458 ' O ' HG21 ' B' ' 77' ' ' VAL . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.523 ' HG3' ' HE3' ' B' ' 105' ' ' MET . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 72.44 111.559 -179.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 74.32 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . 0.458 HG21 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 74.43 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 74.31 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.511 ' HB2' HG13 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 62.35 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.52 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 74.12 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.585 ' HA ' ' HE3' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 72.51 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 74.34 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.455 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.43 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 72.44 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.488 HD23 HG13 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 74.12 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG23 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . 0.567 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 73.45 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.408 ' HZ1' HG21 ' B' ' 20' ' ' THR . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 70.51 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.589 HG22 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 73.22 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.589 HG23 HG22 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 44.24 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 74.22 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.567 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 73.4 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 71.34 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . 0.426 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 55.23 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 74.45 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 73.44 114.626 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.523 ' HE3' ' HG3' ' B' ' 74' ' ' LYS . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 73.01 110.789 172.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 73.43 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.545 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 52.03 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 73.35 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 75.15 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 74.23 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.551 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 71.45 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.719 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.609 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 74.31 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.544 HG23 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.609 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 75.12 110.389 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 61.43 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 71.44 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 74.21 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.454 HG22 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.468 ' HA ' HG21 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 75.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.437 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 73.43 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.517 HD11 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 72.0 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.468 HG21 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 71.4 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.594 ' HB2' HD13 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.633 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 73.12 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 75.24 110.379 178.089 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.556 1.211 0 CA-C-O 120.722 0.296 . . . . 74.54 111.226 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 71.23 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.627 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 71.31 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 75.32 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 73.3 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.627 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 73.41 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 63.2 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 74.11 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.434 HD22 HD11 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 65.31 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.59 HG11 HD22 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 74.43 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 74.32 110.917 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.483 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.598 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 71.44 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 73.21 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.46 HD13 HD23 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 75.23 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 72.34 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' A' ' 118' ' ' LEU . 17.0 mm100 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 73.5 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 74.05 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.13 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 73.44 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 71.22 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.508 ' HB3' HD11 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 75.24 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 75.12 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 74.33 112.094 177.025 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 112.019 0.377 . . . . 74.04 112.019 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.439 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 74.15 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.439 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 73.02 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.598 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 75.31 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 74.01 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 75.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.508 HD11 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 75.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.46 HD23 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.55 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.46 ' NH2' HG22 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 75.13 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 73.13 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.549 ' HD2' ' HE2' ' A' ' 105' ' ' MET . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 74.4 111.009 170.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 63.43 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.527 ' HB2' HG12 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.413 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.55 111.621 176.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.5 110.494 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.449 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.432 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 73.33 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.59 HD22 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 75.11 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.45 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.668 HG21 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.21 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.668 HG23 HG21 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 74.24 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 70.44 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 75.33 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.456 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.549 ' HE2' ' HD2' ' A' ' 74' ' ' LYS . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 74.42 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 73.42 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 73.04 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 71.02 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.25 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.505 HD23 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 74.41 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' MET . . . . . 0.472 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 73.21 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 120' ' ' MET . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 71.34 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 75.22 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 64.04 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.515 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 72.12 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.688 ' HA ' HG21 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.5 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 74.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.688 HG21 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 64.41 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.504 ' HB2' HD12 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 73.53 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 74.31 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 74.42 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 75.54 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . 0.414 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 65.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 72.24 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.486 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.681 HG11 HD22 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 71.14 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 74.43 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 74.43 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.482 HG23 HD13 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 75.24 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.462 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.481 HD11 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 73.11 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 75.42 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . 0.593 ' HG3' HD21 ' B' ' 118' ' ' LEU . 15.2 mm100 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 62.15 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 63.12 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.482 HD13 HG23 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 74.31 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 73.13 110.157 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 64.35 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 62.11 112.079 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 30.4 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 74.22 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 74.1 110.738 166.152 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . 0.421 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp . . . . . 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 65.13 113.954 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 74.3 111.689 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 75.42 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 72.2 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 74.34 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 65.33 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . 0.561 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 74.35 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 74.34 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 64.11 114.75 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 72.44 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 74.32 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 74.43 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 74.31 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.53 ' HB2' HG12 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . 0.462 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 62.35 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 74.12 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 72.51 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 74.34 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.43 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . 0.409 ' HG3' HD21 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 72.44 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.681 HD22 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 74.12 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . 0.526 ' HH ' HG21 ' B' ' 102' ' ' VAL . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 73.45 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.515 ' HD3' HD11 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 70.51 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . 0.437 HG21 HG22 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 73.22 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.437 HG22 HG21 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 44.24 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 74.22 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . 0.583 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 73.4 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 71.34 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 55.23 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 74.45 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.495 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 73.44 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 73.01 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 73.43 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.475 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 52.03 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 73.35 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 75.15 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 74.23 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . 0.593 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 71.45 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.44 ' O ' HG21 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.529 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 74.31 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.529 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 75.12 110.445 -178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 61.43 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 71.44 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 74.21 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . 0.436 HG21 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.479 ' HA ' HG21 ' B' ' 134' ' ' THR . 8.3 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 75.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 73.43 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 72.0 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.479 HG21 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 71.4 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.608 ' HB2' HD13 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 73.12 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.428 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 75.24 112.815 -171.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 71.23 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.414 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.445 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 71.31 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 75.32 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 73.3 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 73.41 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.458 ' HG2' HD13 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 63.2 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 74.11 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.591 HD22 HD11 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 65.31 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.466 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.479 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 74.43 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 74.32 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.74 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 71.44 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 73.21 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 75.23 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 72.34 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 73.5 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 74.05 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.13 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 73.44 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 71.22 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.672 ' HB3' HD11 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 75.24 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.772 ' HB3' HD23 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 75.12 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.414 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 74.33 110.734 169.931 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 74.04 114.082 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.615 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.466 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 74.15 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.615 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 73.02 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' VAL . . . . . 0.74 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 75.31 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 74.01 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.526 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 75.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 75.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.55 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 75.13 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 73.13 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.543 ' HD2' ' HE1' ' A' ' 105' ' ' MET . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 74.4 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.407 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 63.43 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.55 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.5 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HG ' ' HE3' ' B' ' 120' ' ' MET . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HB3' HD22 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 73.33 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' PRO . . . . . 0.72 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.591 HD11 HD22 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TYR . . . . . 0.516 ' HA ' HG21 ' A' ' 94' ' ' VAL . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 75.11 112.224 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.432 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.45 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.516 HG21 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.21 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.499 HG21 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 74.24 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.412 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . 0.484 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 70.44 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.72 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 75.33 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . 0.416 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . 0.44 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' MET . . . . . 0.543 ' HE1' ' HD2' ' A' ' 74' ' ' LYS . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 74.42 111.412 170.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.46 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 73.42 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 73.04 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . 0.472 ' HG3' HG22 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 71.02 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' LEU . . . . . 0.46 ' HB2' HD13 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.25 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' LEU . . . . . 0.643 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 74.41 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 73.21 112.895 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' THR . . . . . 0.642 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' MET . . . . . 0.642 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 71.34 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.417 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 75.22 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 64.04 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 72.12 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLN . . . . . 0.523 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.5 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 74.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' THR . . . . . 0.523 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 64.41 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.532 ' HB2' HD12 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 73.53 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 74.31 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HZ1' ' HB3' ' A' ' 140' ' ' LYS . 9.2 mtpm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 74.42 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 75.54 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.404 ' O ' HG21 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 65.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 72.24 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' LEU . . . . . 0.716 HD22 HD11 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' THR . . . . . 0.54 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' VAL . . . . . 0.507 HG12 HD22 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 71.14 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' ASP . . . . . 0.452 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 74.43 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.839 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 74.43 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ILE . . . . . 0.636 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' THR . . . . . 0.442 ' HA ' HD11 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 75.24 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' TYR . . . . . 0.422 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.51 HD12 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 73.11 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 75.42 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' CYS . . . . . 0.4 ' HG ' ' HG2' ' B' ' 81' ' ' GLU . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 62.15 111.226 170.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' LYS . . . . . 0.424 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 63.12 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' LEU . . . . . 0.557 HD23 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 74.31 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 73.13 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 64.35 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 62.11 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.557 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 74.22 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 74.1 110.308 167.206 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.494 1.739 0 N-CA-C 111.979 0.363 . . . . 65.13 111.979 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' ARG . . . . . 0.452 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 74.3 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' LYS . . . . . 0.525 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 75.42 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 72.2 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' VAL . . . . . 0.839 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 74.41 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 74.34 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' LEU . . . . . 0.403 HD11 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 65.33 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 74.35 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' LEU . . . . . 0.51 HD11 HD12 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 74.34 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' ARG . . . . . 0.544 ' HG3' HG21 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.544 HG21 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 64.11 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' LYS . . . . . 0.501 ' HD2' ' HE3' ' B' ' 105' ' ' MET . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 72.44 111.297 171.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 74.32 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 74.43 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 74.31 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . 0.427 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' GLU . . . . . 0.422 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 62.35 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 74.12 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.622 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 72.51 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 74.34 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.43 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 72.44 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 90' ' ' LEU . . . . . 0.716 HD11 HD22 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 74.12 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 73.45 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 93' ' ' LYS . . . . . 0.611 ' HZ1' ' HB3' ' B' ' 93' ' ' LYS . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 70.51 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 73.22 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 95' ' ' THR . . . . . 0.47 ' HB ' ' HZ2' ' B' ' 97' ' ' LYS . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 44.24 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HZ2' ' HB ' ' B' ' 95' ' ' THR . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 74.22 111.997 178.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 73.4 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 71.34 112.654 172.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 55.23 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 74.45 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 103' ' ' PHE . . . . . 0.489 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 73.44 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 105' ' ' MET . . . . . 0.501 ' HE3' ' HD2' ' B' ' 74' ' ' LYS . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 106' ' ' ILE . . . . . 0.519 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 107' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 73.01 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 73.43 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 109' ' ' ALA . . . . . 0.424 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 52.03 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 73.35 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 115' ' ' LEU . . . . . 0.519 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 75.15 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 74.23 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 71.45 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 119' ' ' LEU . . . . . 0.643 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 120' ' ' MET . . . . . 0.421 ' HE3' ' HG ' ' A' ' 85' ' ' LEU . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 121' ' ' THR . . . . . 0.494 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.622 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 74.31 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 123' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 124' ' ' MET . . . . . 0.494 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 75.12 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 125' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 126' ' ' LEU . . . . . 0.417 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 61.43 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 127' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 71.44 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 128' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 74.21 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 131' ' ' GLN . . . . . 0.577 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 75.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 73.43 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 72.0 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 134' ' ' THR . . . . . 0.577 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 71.4 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 136' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 137' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 73.12 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 140' ' ' LYS . . . . . 0.423 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 75.24 113.775 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.676 0 CA-C-O 119.789 -0.451 . . . . 74.14 113.022 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t 60.25 -170.04 0.15 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.157 0.983 . . . . 73.52 110.922 -173.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -157.16 -166.31 2.03 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 121.765 -0.584 . . . . 72.41 110.202 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -133.65 -22.97 1.86 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.179 0.592 . . . . 72.45 111.771 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.7 147.66 29.38 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.907 0.706 . . . . 63.21 112.907 -173.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -96.51 104.84 16.85 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.962 0.905 . . . . 74.03 110.456 -177.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -168.2 173.75 7.64 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.021 0.528 . . . . 73.33 110.428 177.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.6 -28.78 68.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.053 0.541 . . . . 74.54 111.082 169.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 71.23 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.605 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 71.31 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 75.32 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 73.3 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 73.41 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 63.2 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 74.11 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 65.31 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.663 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.549 HG11 HD22 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 74.43 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 74.32 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.587 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.407 ' O ' ' HG ' ' A' ' 34' ' ' LEU . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.467 HG22 HD13 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 71.44 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 73.21 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 75.23 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.421 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 72.34 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 73.5 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 74.05 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.467 HD13 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.13 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 73.44 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 71.22 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.686 ' HB3' HD11 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 75.24 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 75.12 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.37 -33.83 73.01 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 74.33 110.744 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.467 ' HB3' ' HE3' ' A' ' 60' ' ' LYS . 37.4 t70 -96.65 107.13 34.62 Favored Pre-proline 0 CA--C 1.559 1.308 0 N-CA-C 108.402 -0.962 . . . . 73.24 108.402 164.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -65.45 -34.16 44.24 Favored 'Trans proline' 0 CA--C 1.559 1.771 0 C-N-CA 122.189 1.926 . . . . 74.43 113.574 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.511 ' HB2' HG23 ' A' ' 55' ' ' VAL . 66.1 m-20 -84.08 -172.32 4.09 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.603 0.716 . . . . 71.45 112.39 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.61 HD21 ' H ' ' A' ' 54' ' ' LEU . 2.4 pt? -91.64 17.97 8.12 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.347 1.059 . . . . 73.24 112.881 176.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 53' ' ' ASN . 50.9 t -57.88 -49.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 C-N-CA 123.327 0.651 . . . . 70.14 112.109 -172.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.467 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt -118.84 28.16 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.729 0.812 . . . . 74.04 111.676 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 74.15 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.587 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 73.02 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.663 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 75.31 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 74.01 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.702 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 75.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.702 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 75.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.4 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.55 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 75.13 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.407 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 73.13 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.605 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.43 ' HD2' ' HE2' ' A' ' 105' ' ' MET . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.4 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 74.4 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 63.43 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.458 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.401 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.55 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.5 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.498 HD22 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 73.33 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.551 ' HG3' HD21 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.551 HD21 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.458 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 75.11 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 93' ' ' LYS . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.45 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.452 HG21 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.21 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 74.24 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 70.44 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 75.33 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.481 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.43 ' HE2' ' HD2' ' A' ' 74' ' ' LYS . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 74.42 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 73.42 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 73.04 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 71.02 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.25 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 74.41 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.602 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 73.21 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.49 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.498 ' HG2' HD22 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.49 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 71.34 110.985 -177.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.533 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 75.22 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 64.04 110.367 175.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.438 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 72.12 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG21 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.5 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 74.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.635 HG21 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 64.41 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.408 ' HB2' HD12 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 73.53 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.481 HD12 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 74.31 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.514 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 10.0 mtpm? -110.21 -164.13 0.9 Allowed 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -69.66 -14.66 62.92 Favored 'General case' 0 CA--C 1.565 1.528 0 C-N-CA 125.098 1.359 . . . . 74.23 113.48 172.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 N--CA 1.496 1.864 0 C-N-CA 124.382 1.073 . . . . 73.44 112.63 -178.444 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 113.687 0.235 . . . . 64.41 113.687 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.1 t -86.03 71.74 10.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.272 0.629 . . . . 74.14 111.472 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 62.45 14.02 6.6 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 124.878 1.271 . . . . 75.31 114.112 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -58.42 -22.03 52.88 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.928 1.291 . . . . 75.11 113.871 -177.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -63.41 161.43 14.24 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.444 1.097 . . . . 72.3 111.789 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -124.31 103.54 8.28 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.726 -0.609 . . . . 64.42 110.062 175.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -161.03 158.87 28.58 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.552 0.741 . . . . 63.54 109.658 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . 0.515 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.516 ' HZ3' HD23 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 74.42 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 75.54 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 65.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.428 HG22 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 72.24 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.531 HD21 HD11 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.497 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.738 HG11 HD23 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 71.14 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.416 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 74.43 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.64 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 74.43 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.416 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.64 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 75.24 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.476 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 73.11 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 75.42 110.97 169.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.538 ' HG3' HD13 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 62.15 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.58 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 63.12 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.457 HD22 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 74.31 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 73.13 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . 0.465 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 64.35 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.448 ' HB3' HG22 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 62.11 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.457 ' HB3' HD22 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.423 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 74.22 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -59.02 -33.52 70.84 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 74.1 109.851 168.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.52 ' HB3' ' HZ2' ' B' ' 60' ' ' LYS . 11.3 t70 -105.02 105.56 52.0 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 124.622 1.169 . . . . 71.51 108.188 161.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.57 -27.09 81.34 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.948 2.432 . . . . 74.43 112.936 175.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -75.69 -176.77 3.43 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.787 0.835 . . . . 64.4 112.238 179.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.442 ' O ' ' HD2' ' B' ' 57' ' ' ARG . 40.3 mt -106.69 44.97 1.01 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.426 -0.806 . . . . 71.35 109.944 174.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 59.7 t -82.94 -55.98 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 122.063 -0.398 . . . . 75.11 110.56 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.413 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt -94.94 25.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 65.13 112.798 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.442 ' HD2' ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 74.3 114.231 -178.289 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 75.42 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.413 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 72.2 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.578 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.497 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 74.41 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 74.34 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.516 HD23 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 65.33 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.448 HG22 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 74.35 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 74.34 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . 0.515 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 64.11 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.501 ' HD2' ' HE3' ' B' ' 105' ' ' MET . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 72.44 112.147 173.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.412 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 74.32 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 74.43 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 74.31 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.464 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 62.35 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 74.12 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 72.51 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 74.34 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD21 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.43 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.454 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 72.44 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.738 HD23 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 74.12 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG21 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 73.45 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.644 ' HB2' ' HZ1' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 70.51 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 73.22 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.491 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 44.24 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.491 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 74.22 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 73.4 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 71.34 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 55.23 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.602 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 74.45 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.439 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 73.44 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.407 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.501 ' HE3' ' HD2' ' B' ' 74' ' ' LYS . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.46 HD13 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 73.01 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 73.43 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.58 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD13 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 52.03 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 73.35 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.401 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 75.15 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 74.23 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.538 HD13 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 71.45 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.582 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.452 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.502 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 74.31 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.501 HG12 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.502 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 75.12 109.815 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 61.43 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 71.44 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.425 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 74.21 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.407 HG22 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.569 ' HA ' HG21 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 75.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 73.43 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.435 ' O ' ' HB2' ' B' ' 137' ' ' LEU . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 72.0 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.569 HG21 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 71.4 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.481 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.452 HD21 ' HD2' ' A' ' 140' ' ' LYS . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 73.12 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' B' ' 140' ' ' LYS . 8.6 mtpm? -103.89 -170.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 75.24 112.116 -177.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -101.0 13.42 35.26 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.609 0.764 . . . . 74.53 112.616 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.709 -0.662 . . . . 72.2 110.802 177.015 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 112.917 -0.073 . . . . 74.14 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -173.89 144.76 1.06 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.144 0.977 . . . . 73.52 110.525 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -67.76 -29.74 69.03 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.04 0.536 . . . . 72.41 110.647 170.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -87.63 -67.28 0.83 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.184 0.994 . . . . 72.45 111.331 -175.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 -79.87 136.45 36.68 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 122.617 0.367 . . . . 63.21 111.7 -176.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 53.71 -3.92 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 117.801 2.519 . . . . 74.03 117.801 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 32.55 87.11 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 115.472 1.656 . . . . 73.33 115.472 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -68.92 -15.83 63.59 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.568 0.747 . . . . 74.54 112.127 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 71.23 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 71.31 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 75.32 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 73.3 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 73.41 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 63.2 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 74.11 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 65.31 111.509 179.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.599 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.428 ' HB ' HD11 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 74.43 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.436 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 74.32 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.508 ' O ' HG22 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.508 HG22 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 71.44 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.52 ' HH ' ' HG3' ' A' ' 122' ' ' GLU . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 73.21 112.401 -179.869 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 75.23 111.748 174.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 72.34 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.426 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 73.5 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 74.05 112.625 174.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.13 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 73.44 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 71.22 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 75.24 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 75.12 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -91.46 -35.48 14.31 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 74.33 113.398 -177.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 60' ' ' LYS . 71.9 m-20 -42.11 147.39 0.56 Allowed Pre-proline 0 N--CA 1.501 2.079 0 N-CA-C 113.709 1.003 . . . . 73.24 113.709 172.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -75.58 19.51 0.54 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 123.314 2.676 . . . . 74.43 113.748 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.544 ' HB2' HG21 ' A' ' 55' ' ' VAL . 31.3 p-10 -169.96 162.51 9.23 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.808 1.243 . . . . 71.45 110.586 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -114.37 19.81 15.95 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.626 0.771 . . . . 73.24 110.426 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.544 HG21 ' HB2' ' A' ' 53' ' ' ASN . 48.0 t -61.46 -30.42 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 123.98 0.912 . . . . 70.14 110.84 172.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.423 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp -106.05 26.39 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 C-N-CA 125.244 1.418 . . . . 74.04 112.015 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.599 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 74.15 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.547 ' HZ2' ' HB2' ' A' ' 51' ' ' ASP . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 73.02 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.455 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 75.31 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 74.01 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.439 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.516 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 75.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.433 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 75.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.55 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.433 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 75.13 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 73.13 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 74.4 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 63.43 111.786 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.498 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.55 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.5 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.41 ' HG ' HG23 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.593 ' HB3' HD22 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 73.33 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.593 HD22 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.498 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.477 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 75.11 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.45 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.524 HG12 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.21 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 74.24 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.477 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.486 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 70.44 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 75.33 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.4 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 74.42 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.538 HG22 HD21 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 73.42 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.594 HD13 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 73.04 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 71.02 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.538 HD21 HG22 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.25 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 74.41 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.466 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 73.21 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.52 ' HG3' ' HH ' ' A' ' 33' ' ' TYR . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 71.34 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 75.22 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 64.04 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.493 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.459 HG12 HD13 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 72.12 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.516 ' HA ' HG23 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.5 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 74.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.53 HD12 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.516 HG23 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 64.41 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 73.53 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.652 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 74.31 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -92.29 -178.7 5.02 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -79.63 -6.23 56.68 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 112.722 0.638 . . . . 74.23 112.722 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.423 0.689 . . . . 73.44 109.706 174.972 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 CA-C-O 119.853 -0.415 . . . . 64.41 112.97 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.3 t -123.25 157.61 32.74 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.2 0.6 . . . . 74.14 112.504 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -99.67 -178.76 3.98 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.644 0.778 . . . . 75.31 110.138 167.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -64.68 -61.49 2.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.042 0.537 . . . . 75.11 111.509 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -84.24 147.79 27.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.43 0.692 . . . . 72.3 109.732 171.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.537 HD21 ' H ' ' B' ' 6' ' ' ASN . 0.0 OUTLIER -75.92 75.04 2.84 Favored 'General case' 0 CA--C 1.565 1.535 0 CA-C-O 122.487 1.137 . . . . 64.42 111.0 174.171 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -86.75 110.04 19.64 Favored 'General case' 0 CA--C 1.563 1.456 0 CA-C-N 115.132 -0.94 . . . . 63.54 110.969 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 74.42 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.514 ' HB ' ' HH ' ' B' ' 76' ' ' TYR . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.597 ' HB3' HD12 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 75.54 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 65.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 72.24 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.597 HD12 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.731 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 71.14 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.456 HD13 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 74.43 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.576 ' HD3' HG23 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 74.43 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.491 HG23 HD12 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 75.24 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 73.11 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 75.42 110.779 171.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 62.15 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.577 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 63.12 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.491 HD12 HG23 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 74.31 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 73.13 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 64.35 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 62.11 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.476 HG23 HD11 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 74.22 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' SER . . . . . 0.402 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t -60.64 -37.47 81.6 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 74.1 112.062 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -79.75 108.75 9.73 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 123.423 0.689 . . . . 71.51 110.094 169.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.78 -43.26 45.51 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.84 2.36 . . . . 74.43 114.183 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.56 124.09 7.69 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.475 0.917 . . . . 64.4 113.475 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.575 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.7 pt? -72.76 -5.15 35.93 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 114.621 -1.172 . . . . 71.35 112.045 168.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -63.66 -41.28 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.637 0.775 . . . . 75.11 111.031 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.524 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp -105.58 23.67 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 124.278 1.031 . . . . 65.13 111.657 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.592 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 74.3 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 75.42 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.524 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 72.2 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.592 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.576 HG23 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 74.41 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.476 HD11 HG23 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 74.34 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.441 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 65.33 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 74.35 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 74.34 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 64.11 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.478 ' O ' HG22 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 72.44 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.514 ' HH ' ' HB ' ' B' ' 13' ' ' VAL . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 74.32 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.478 HG22 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 74.43 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 74.31 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 62.35 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 74.12 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 72.51 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 74.34 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.638 ' HB3' HD22 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.43 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 72.44 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.731 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 74.12 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.431 ' HA ' HG23 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.479 ' HZ1' ' HB3' ' B' ' 92' ' ' LYS . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 73.45 112.905 176.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.512 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 70.51 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.543 HG22 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 73.22 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.543 HG23 HG22 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 44.24 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 74.22 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 73.4 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 71.34 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.488 ' HB1' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 55.23 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 74.45 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.488 HG23 ' HB1' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 73.44 114.415 173.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.588 HD11 ' HG ' ' B' ' 110' ' ' SER . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.588 HD13 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 73.01 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 73.43 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.577 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' SER . . . . . 0.588 ' HG ' HD11 ' B' ' 106' ' ' ILE . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.588 ' HA ' HD13 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 52.03 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 73.35 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.58 HD11 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 75.15 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.594 HG21 HD13 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 74.23 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 71.45 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.517 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.402 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 74.31 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.517 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.402 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 75.12 110.419 -178.247 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.564 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 61.43 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 71.44 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.501 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 74.21 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 75.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.484 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 73.43 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 72.0 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.53 ' HB ' HD12 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 71.4 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.652 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 73.12 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.595 ' HZ1' ' HB3' ' B' ' 140' ' ' LYS . 8.1 mtpm? -72.88 168.44 18.9 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 75.24 110.274 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.96 -26.81 69.0 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.158 0.504 . . . . 74.53 110.762 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.577 1.982 0 C-N-CA 124.263 1.025 . . . . 72.2 111.111 172.812 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.076 0 CA-C-O 120.118 -0.268 . . . . 74.14 113.058 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -151.3 -179.89 7.74 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.78 0.832 . . . . 73.52 110.174 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -67.76 150.45 48.63 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.226 0.61 . . . . 72.41 111.698 171.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -75.19 -72.43 0.3 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.763 0.825 . . . . 72.45 111.64 -176.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -68.35 157.62 35.28 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.686 0.394 . . . . 63.21 110.529 172.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -74.27 82.04 1.85 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.495 0.554 . . . . 74.03 112.495 -172.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -69.6 94.39 0.77 Allowed 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.436 -1.32 . . . . 73.33 107.436 169.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.48 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 -89.03 -6.81 56.9 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 174.732 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 71.23 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.451 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 71.31 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 75.32 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 73.3 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.477 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 73.41 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.477 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 63.2 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.694 HG22 ' HZ3' ' A' ' 93' ' ' LYS . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 74.11 111.13 176.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.443 HD23 HD11 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 65.31 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.644 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.465 HG13 HD23 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 74.43 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.42 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 74.32 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.685 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.442 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.539 HG22 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 71.44 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.448 ' HB2' HD21 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.43 ' HA ' HD11 ' A' ' 118' ' ' LEU . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 73.21 110.275 177.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 75.23 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 72.34 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 73.5 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.439 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 74.05 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.448 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.13 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 73.44 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 71.22 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 75.24 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 75.12 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -58.49 -33.41 69.77 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 74.33 110.59 168.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.45 126.05 30.46 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.958 1.303 . . . . 73.24 109.242 170.191 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.12 -26.29 4.41 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 C-N-CA 122.656 2.237 . . . . 74.43 115.8 -170.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -61.5 144.51 54.12 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.817 1.043 . . . . 71.45 113.817 -170.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.449 HD21 ' H ' ' A' ' 54' ' ' LEU . 2.6 pt? -83.59 -7.97 59.41 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.392 -0.822 . . . . 73.24 110.666 173.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 t -65.69 -30.87 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.572 0.701 . . . . 70.14 110.685 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt -105.44 24.39 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 124.719 1.207 . . . . 74.04 112.3 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 74.15 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.685 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 73.02 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.644 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 75.31 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 74.01 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.552 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.503 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 75.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.516 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 75.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.477 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.55 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.516 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 75.13 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 73.13 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.448 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 74.4 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 63.43 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.477 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.4 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.55 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.5 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.442 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.595 ' HB3' HD21 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 73.33 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.595 HD21 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.4 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 75.11 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.694 ' HZ3' HG22 ' A' ' 20' ' ' THR . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.45 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.21 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 74.24 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 70.44 115.235 174.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 75.33 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.482 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 74.42 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.469 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 73.42 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.482 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 73.04 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 71.02 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD13 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.25 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.448 HD21 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 74.41 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 73.21 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.516 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.442 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.434 HG11 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.516 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 71.34 109.935 176.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 75.22 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 64.04 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 72.12 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.5 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.428 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 74.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.476 HD11 HG12 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 64.41 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.587 ' HB2' HD12 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 73.53 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.564 HD12 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 74.31 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -72.77 142.05 48.11 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -118.93 43.31 2.59 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.6 1.56 . . . . 74.23 107.057 171.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 CA--C 1.564 1.511 0 CA-C-N 114.173 -1.376 . . . . 73.44 112.21 -164.88 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 CA-C-O 120.075 -0.291 . . . . 64.41 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 57.1 m -143.93 174.85 10.48 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.39 0.676 . . . . 74.14 111.625 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.476 ' HB2' ' HE1' ' B' ' 73' ' ' HIS . 3.8 p-10 -99.73 128.97 45.81 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 124.34 1.056 . . . . 75.31 112.335 -173.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -142.93 -9.62 0.79 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.948 0.899 . . . . 75.11 113.388 -171.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -65.26 -179.41 0.59 Allowed 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 113.45 0.907 . . . . 72.3 113.45 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -105.92 86.75 2.44 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.52 0.728 . . . . 64.42 109.125 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . 0.516 ' H ' ' HB2' ' B' ' 73' ' ' HIS . 8.1 p-10 -149.17 129.16 13.46 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 -172.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . 0.405 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.431 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 74.42 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . 0.474 HG13 HG21 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 75.54 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.711 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 65.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 72.24 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.531 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.587 HG13 HD23 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 71.14 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 74.43 109.405 172.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.451 ' HB3' HD12 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 74.43 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.503 HG23 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 75.24 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.451 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 73.11 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 75.42 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 62.15 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.441 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 63.12 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.579 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 74.31 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 73.13 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 64.35 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.549 ' HA ' HE21 ' B' ' 47' ' ' GLN . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 62.11 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.579 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.549 HE21 ' HA ' ' B' ' 44' ' ' ASP . 29.3 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.509 HG12 ' HB2' ' B' ' 64' ' ' LEU . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.451 HD12 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 74.22 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m -80.81 -4.1 53.44 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 74.1 111.587 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.519 ' HB2' ' HZ2' ' B' ' 60' ' ' LYS . 4.8 m-20 -66.21 142.9 98.11 Favored Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 124.395 1.078 . . . . 71.51 110.852 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.41 2.44 6.28 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 C-N-CA 122.835 2.357 . . . . 74.43 113.606 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.406 ' HB2' HG22 ' B' ' 55' ' ' VAL . 25.2 p30 -176.66 -176.92 0.76 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 64.4 110.928 -171.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -104.32 1.5 30.39 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.52 0.728 . . . . 71.35 110.434 167.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.406 HG22 ' HB2' ' B' ' 53' ' ' ASN . 42.9 t -64.59 -31.55 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.605 0.762 . . . . 75.11 111.162 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.43 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt -93.32 26.76 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.086 0.955 . . . . 65.13 112.529 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.492 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 74.3 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 75.42 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.43 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 72.2 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.547 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 74.41 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.432 HG22 HG11 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.509 ' HB2' HG12 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 74.34 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.431 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 65.33 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 74.35 110.762 174.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.451 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 74.34 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . 0.405 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 64.11 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.516 ' HB2' ' H ' ' B' ' 7' ' ' ASP . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 72.44 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.551 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 74.32 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 74.43 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 74.31 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 62.35 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 74.12 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 72.51 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 74.34 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.671 ' HB3' HD21 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.43 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.465 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 72.44 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.671 HD21 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 74.12 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.424 ' CZ ' HG22 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 73.45 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.401 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 70.51 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.711 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 73.22 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.595 HG23 HG22 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 44.24 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 74.22 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 73.4 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.675 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 71.34 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 55.23 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.675 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 74.45 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.404 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 73.44 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.633 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.503 HD11 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.633 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 73.01 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 73.43 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 52.03 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.472 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 73.35 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.503 ' HB2' HD11 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 75.15 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 74.23 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 71.45 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.538 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.494 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.404 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 74.31 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.494 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.404 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 75.12 110.187 177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.572 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 61.43 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 71.44 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.467 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 74.21 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.476 HG12 HD11 ' A' ' 133' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.7 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 75.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.494 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 73.43 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.509 HD12 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 72.0 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 71.4 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.564 ' HB2' HD12 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.587 HD12 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 73.12 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -86.96 155.09 20.33 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 75.24 111.944 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.0 72.95 2.22 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.67 -0.863 . . . . 74.53 108.67 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 CA--C 1.564 1.481 0 CA-C-N 115.433 -0.803 . . . . 72.2 110.846 -177.031 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.934 0 CA-C-O 120.4 -0.111 . . . . 74.14 113.207 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 t -73.72 96.84 2.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.124 0.57 . . . . 73.52 111.024 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -82.81 121.61 27.14 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.257 0.551 . . . . 72.41 111.761 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -107.95 -31.3 8.04 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.398 1.079 . . . . 72.45 109.578 171.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -78.82 -13.14 59.97 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.358 1.063 . . . . 63.21 113.286 -172.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -76.28 125.52 29.33 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.877 -0.416 . . . . 74.03 109.877 174.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.03 92.38 2.14 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-O 121.671 0.748 . . . . 73.33 111.51 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.95 -16.5 50.25 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.606 1.163 . . . . 74.54 112.379 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 71.23 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 71.31 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 75.32 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 73.3 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 73.41 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 63.2 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 74.11 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.522 HD23 HD13 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 65.31 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.682 HG12 HD22 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 74.43 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.558 HD11 HD12 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 74.32 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.626 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.424 ' HG ' HD11 ' A' ' 49' ' ' LEU . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.402 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.561 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 71.44 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 73.21 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 75.23 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.419 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 72.34 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.544 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 73.5 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.737 ' HA ' ' HZ2' ' A' ' 38' ' ' LYS . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 74.05 112.288 173.548 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.776 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.13 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 73.44 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.419 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 71.22 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.585 ' HB2' HD11 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 75.24 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.776 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 75.12 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.492 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.424 HD11 ' HG ' ' A' ' 28' ' ' SER . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p -61.08 -36.07 78.65 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 74.33 110.398 170.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -95.54 125.38 49.73 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.504 1.122 . . . . 73.24 108.984 166.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -67.64 -32.63 30.25 Favored 'Trans proline' 0 CA--C 1.558 1.705 0 C-N-CA 122.29 1.993 . . . . 74.43 112.247 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -79.42 176.45 9.68 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.015 0.926 . . . . 71.45 112.052 -178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.508 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -98.37 28.49 4.09 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.039 0.535 . . . . 73.24 112.112 173.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.7 t -66.28 -47.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.892 -0.505 . . . . 70.14 111.182 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt -98.88 25.36 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.42 0.688 . . . . 74.04 112.168 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 74.15 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.626 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 73.02 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.453 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 75.31 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 74.01 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.595 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 75.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.595 HD12 ' HA ' ' A' ' 64' ' ' LEU . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 75.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.55 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 75.13 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 73.13 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.556 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 74.4 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.431 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 63.43 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.436 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.544 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.55 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.558 HD12 HD11 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.5 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.681 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 73.33 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.682 HD22 HG12 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.544 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.579 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 75.11 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.45 112.337 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.21 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 74.24 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.463 ' HZ1' ' HB3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.579 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.48 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 70.44 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 75.33 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.546 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.556 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 74.42 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.544 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 73.42 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 73.04 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 71.02 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.546 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.25 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.482 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 74.41 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.679 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 73.21 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.466 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 71.34 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.429 ' HE3' ' HB3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 75.22 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 64.04 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.413 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.437 HG22 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 72.12 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.726 ' HA ' HG21 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.5 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 74.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.726 HG21 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 64.41 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.478 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 73.53 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.509 HD12 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 74.31 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.405 ' HD2' HD22 ' B' ' 137' ' ' LEU . 43.3 mtpt -70.65 -176.97 1.41 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -73.28 -17.76 61.29 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 115.553 -0.749 . . . . 74.23 112.442 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 . . . . . 0 CA--C 1.575 1.926 0 CA-C-O 118.57 -0.728 . . . . 73.44 111.598 175.521 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 120.053 -0.304 . . . . 64.41 112.645 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 24.7 t -103.75 18.15 22.56 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.468 0.707 . . . . 74.14 110.82 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -68.98 166.89 17.0 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.885 1.274 . . . . 75.31 112.138 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -104.88 -36.71 7.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.381 0.672 . . . . 75.11 111.791 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.55 15.06 1.79 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 114.18 1.178 . . . . 72.3 114.18 -170.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -71.08 117.93 13.2 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.506 0.67 . . . . 64.42 110.769 172.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . 0.547 ' H ' ' HA2' ' B' ' 72' ' ' GLY . 29.4 t70 -94.35 82.42 4.07 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.046 0.938 . . . . 63.54 111.221 -170.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 74.42 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.445 HD22 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 75.54 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 65.41 111.998 -173.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 72.24 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.559 ' HA ' HD11 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.546 HG21 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.636 HG11 HD22 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 71.14 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.559 HD11 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 74.43 109.713 175.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.678 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 74.43 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 75.24 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.415 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 73.11 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 75.42 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' B' ' 118' ' ' LEU . 13.9 mm100 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 62.15 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 63.12 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.537 HD23 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 74.31 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 73.13 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 64.35 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.605 ' HB3' HD11 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 62.11 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.537 ' HB3' HD23 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD13 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 74.22 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -58.44 -34.46 70.84 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 74.1 111.412 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.561 ' HB2' ' HZ2' ' B' ' 60' ' ' LYS . 3.1 m-20 -116.1 106.76 48.85 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.049 -1.093 . . . . 71.51 108.049 171.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.92 -23.42 13.99 Favored 'Trans proline' 0 CA--C 1.557 1.672 0 C-N-CA 122.06 1.84 . . . . 74.43 113.175 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -97.85 176.43 5.8 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.605 0.762 . . . . 64.4 111.593 -171.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.606 ' HA ' ' HB2' ' B' ' 57' ' ' ARG . 1.0 OUTLIER -89.56 26.28 1.76 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.51 0.929 . . . . 71.35 113.51 -174.411 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.4 t -61.09 -51.77 69.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 C-N-CA 123.228 0.611 . . . . 75.11 111.09 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp -122.26 25.24 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.061 0.944 . . . . 65.13 111.856 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.606 ' HB2' ' HA ' ' B' ' 54' ' ' LEU . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 74.3 114.086 -178.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 75.42 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 72.2 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.561 ' HZ2' ' HB2' ' B' ' 51' ' ' ASP . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.678 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 74.41 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.55 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 74.34 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 65.33 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.605 HD11 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 74.35 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.593 HD12 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 74.34 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . 0.547 ' HA2' ' H ' ' B' ' 7' ' ' ASP . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 64.11 113.468 -177.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.44 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 72.44 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 74.32 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.44 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 74.43 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 74.31 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.593 ' HB2' HD12 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 62.35 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 74.12 111.554 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.495 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 72.51 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 74.34 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.514 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.43 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.625 ' HG3' HD21 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 72.44 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.636 HD22 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 74.12 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.68 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 73.45 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 70.51 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.445 ' HB ' HD22 ' B' ' 14' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 73.22 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 44.24 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 74.22 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.68 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 73.4 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 71.34 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 55.23 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.679 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 74.45 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.471 ' O ' HG12 ' B' ' 107' ' ' ILE . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 73.44 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.501 HG21 HD11 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.471 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 73.01 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 73.43 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.468 ' HA ' HD13 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 52.03 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 73.35 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.501 HD11 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 75.15 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 74.23 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 71.45 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.553 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.524 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 74.31 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.524 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 75.12 109.892 -179.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.525 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 61.43 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 71.44 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 74.21 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.427 HG21 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.596 ' HA ' HG21 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 75.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 73.43 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.659 HD12 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 72.0 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.596 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 71.4 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.509 ' HB2' HD12 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.478 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 73.12 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.558 ' HZ1' ' HB3' ' B' ' 140' ' ' LYS . 10.0 mtpm? -84.9 -162.75 0.73 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 75.24 111.583 172.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -57.59 -35.6 70.62 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 123.749 0.82 . . . . 74.53 111.628 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 124.461 1.104 . . . . 72.2 108.688 171.57 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 113.965 0.346 . . . . 74.14 113.965 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -126.34 -177.07 3.85 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.694 0.798 . . . . 73.52 111.342 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.95 153.29 24.0 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.1 0.56 . . . . 72.41 111.882 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -67.68 -27.13 66.58 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.851 0.86 . . . . 72.45 111.406 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -99.38 151.61 20.89 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.487 1.115 . . . . 63.21 110.192 174.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -156.88 -64.85 0.1 Allowed 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.796 0.439 . . . . 74.03 111.675 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -133.41 -2.54 3.08 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 123.17 0.588 . . . . 73.33 111.745 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 -59.72 -11.94 6.12 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.952 0.901 . . . . 74.54 112.803 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 71.23 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ3' HD21 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 71.31 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 75.32 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 73.3 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 73.41 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 63.2 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 74.11 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.471 HD22 HD13 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 65.31 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.673 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.514 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.568 HG11 HD22 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 74.43 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.476 HD11 HD13 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 74.32 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.688 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 71.44 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.435 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 73.21 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.443 HD11 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 75.23 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.412 ' HG2' HD21 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 72.34 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.608 ' NE2' HD11 ' A' ' 118' ' ' LEU . 18.1 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 73.5 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 74.05 114.036 173.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.412 HD21 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.13 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 73.44 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 71.22 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 75.24 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.411 ' H ' HD22 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 75.12 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -61.11 -36.04 78.63 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 74.33 111.108 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -98.87 119.9 59.96 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.231 1.413 . . . . 73.24 109.196 172.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -74.88 -42.75 0.49 Allowed 'Trans proline' 0 C--N 1.378 2.079 0 C-N-CA 122.921 2.414 . . . . 74.43 115.491 -169.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 51.2 m-20 -69.48 173.94 5.43 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.791 0.663 . . . . 71.45 112.791 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.479 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -116.56 26.17 10.06 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.871 0.468 . . . . 73.24 112.22 177.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.9 t -69.2 -27.2 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-O 121.177 0.513 . . . . 70.14 110.281 173.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt -116.62 27.35 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.5 0 C-N-CA 124.461 1.105 . . . . 74.04 112.149 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.406 ' HB3' ' HB2' ' A' ' 54' ' ' LEU . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.587 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 74.15 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.688 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 73.02 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.673 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 75.31 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 74.01 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.539 HD23 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 75.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 75.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.443 HD21 HD11 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.55 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 75.13 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.409 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 73.13 110.983 172.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.409 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 74.4 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 63.43 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.55 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.476 HD13 HD11 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.5 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HG ' ' HE2' ' B' ' 120' ' ' MET . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 73.33 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.568 HD22 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.406 ' HA ' HG21 ' A' ' 94' ' ' VAL . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 75.11 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.45 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.447 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.21 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.447 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 74.24 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 70.44 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 75.33 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 74.42 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.697 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 73.42 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.458 HD13 HG22 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 73.04 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 71.02 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.697 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.43 HG22 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.449 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.25 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.608 HD11 ' NE2' ' A' ' 36' ' ' GLN . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.498 ' O ' HG12 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 74.41 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.456 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 73.21 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.541 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.541 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 71.34 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 75.22 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.475 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 64.04 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.523 HG11 HD12 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 72.12 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.459 ' HA ' HG23 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.5 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 74.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 64.41 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 73.53 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 74.31 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -78.76 161.84 26.56 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -54.24 -19.6 5.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.369 1.248 . . . . 74.23 114.369 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 CA--C 1.57 1.724 0 C-N-CA 123.335 0.654 . . . . 73.44 111.208 176.446 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 CA-C-O 120.258 -0.19 . . . . 64.41 112.871 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 73.2 m -140.17 176.84 8.42 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.712 0.805 . . . . 74.14 111.141 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -72.16 136.65 46.54 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.064 0.546 . . . . 75.31 111.29 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -85.44 -48.88 8.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.893 0.877 . . . . 75.11 110.658 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -72.76 93.28 1.64 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.749 0.785 . . . . 72.3 111.809 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -126.7 -157.77 0.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.803 1.241 . . . . 64.42 107.765 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -132.31 44.99 2.82 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 165.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.462 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 74.42 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 75.54 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.493 ' NH2' HE22 ' B' ' 69' ' ' GLN . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 65.41 112.011 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 72.24 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.579 ' HA ' HD11 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.562 HG23 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.663 HG13 HD22 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 71.14 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.438 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 74.43 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.684 ' HD3' HG21 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.515 ' HB3' HD12 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 74.43 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.448 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.521 HG21 HD12 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 75.24 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 73.11 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 75.42 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.547 ' HG3' HD11 ' B' ' 118' ' ' LEU . 0.0 OUTLIER -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 62.15 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 63.12 112.851 175.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.662 HD22 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 74.31 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 73.13 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 64.35 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 62.11 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.662 ' HB3' HD22 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.585 HG21 HG22 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.515 HD12 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 74.22 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -63.25 -33.33 75.26 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 74.1 109.492 161.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -104.24 107.65 58.01 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 125.007 1.323 . . . . 71.51 108.384 164.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.21 -28.58 10.55 Favored 'Trans proline' 0 CA--C 1.555 1.529 0 C-N-CA 121.848 1.699 . . . . 74.43 112.752 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -61.04 -87.87 0.01 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.046 0.939 . . . . 64.4 113.484 -177.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 2.4 pt? 178.52 -7.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 122.967 0.507 . . . . 71.35 111.684 -170.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 62.3 t -56.47 -39.28 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 124.347 1.059 . . . . 75.11 113.06 -168.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 27.2 pt -112.12 23.97 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 65.13 113.562 -172.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.476 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 74.3 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.48 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 75.42 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 72.2 110.943 176.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.529 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.684 HG21 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 74.41 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.585 HG22 HG21 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 74.34 111.009 173.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.462 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 65.33 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.407 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 74.35 110.693 177.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.445 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 74.34 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.493 HE22 ' NH2' ' B' ' 18' ' ' ARG . 65.1 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.579 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 64.11 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.579 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 72.44 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . 0.445 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 74.32 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 74.43 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 74.31 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.438 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.477 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.438 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 62.35 109.868 173.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 74.12 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.477 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.538 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 72.51 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 74.34 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.43 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 72.44 111.779 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.663 HD22 HG13 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 74.12 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.45 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 73.45 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.532 ' HZ3' ' HB3' ' B' ' 93' ' ' LYS . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 70.51 112.488 179.573 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.453 HG21 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 73.22 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.453 HG23 HG21 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 44.24 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.576 ' HZ2' ' HB1' ' B' ' 100' ' ' ALA . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 74.22 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 73.4 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.421 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 71.34 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.576 ' HB1' ' HZ2' ' B' ' 97' ' ' LYS . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 55.23 111.305 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.449 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 74.45 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.538 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 73.44 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.427 ' HE2' ' HD2' ' B' ' 74' ' ' LYS . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.43 HD11 HG22 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 73.01 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 73.43 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 52.03 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 73.35 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 75.15 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.458 HG22 HD13 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 74.23 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.547 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 71.45 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.421 ' HE2' ' HG ' ' A' ' 85' ' ' LEU . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.644 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 74.31 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.448 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.644 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 75.12 109.48 178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.407 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 61.43 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 71.44 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.47 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 74.21 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.444 HG21 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG23 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 75.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 73.43 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.523 HD12 HG11 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 72.0 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.615 HG23 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 71.4 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 73.12 108.331 176.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.65 161.74 19.11 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 75.24 111.784 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.866 0.867 . . . . 74.53 111.52 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 CA--C 1.57 1.744 0 C-N-CA 123.999 0.92 . . . . 72.2 110.46 174.671 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 120.498 -0.057 . . . . 74.14 112.989 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 77.8 p -114.42 48.41 1.12 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 73.52 110.768 177.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.21 -44.78 59.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.128 0.971 . . . . 72.41 111.463 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -70.39 -32.64 70.37 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.027 0.531 . . . . 72.45 111.082 175.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 38.1 mm-40 -69.9 146.49 51.19 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.003 0.521 . . . . 63.21 110.493 168.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -71.34 -17.32 62.44 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.898 0.479 . . . . 74.03 111.651 171.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.576 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 14.5 t70 64.14 43.63 4.91 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.777 1.231 . . . . 73.33 110.401 -177.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.01 -14.64 58.4 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 114.843 -1.072 . . . . 74.54 112.102 176.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 71.23 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 71.31 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 75.32 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 73.3 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 73.41 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.468 ' HB2' HG13 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 63.2 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 74.11 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.488 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 65.31 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.474 ' O ' ' HG2' ' A' ' 57' ' ' ARG . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.466 HG13 HD22 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 74.43 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.428 HD12 HD21 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 74.32 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.539 ' HA ' HD13 ' A' ' 40' ' ' LEU . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 71.44 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 73.21 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 75.23 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 72.34 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 73.5 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 74.05 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.737 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.13 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 73.44 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 71.22 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.607 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 75.24 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.737 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 75.12 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.445 HG21 HG21 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t -94.15 2.55 55.95 Favored 'General case' 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 74.33 109.12 166.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.409 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 5.8 t0 -150.73 122.31 3.95 Favored Pre-proline 0 CA--C 1.559 1.311 0 C-N-CA 125.326 1.45 . . . . 73.24 109.282 -174.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -86.56 -19.2 2.92 Favored 'Trans proline' 0 CA--C 1.565 2.032 0 C-N-CA 122.623 2.216 . . . . 74.43 113.523 172.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -99.35 -155.5 0.51 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.262 1.025 . . . . 71.45 111.211 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.554 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.96 27.49 4.48 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.663 0.785 . . . . 73.24 113.043 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.2 t -69.41 -57.64 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.849 -0.532 . . . . 70.14 111.356 -174.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -117.9 23.43 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 123.233 0.613 . . . . 74.04 111.007 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.668 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 74.15 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.668 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 73.02 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.47 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 75.31 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 74.01 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.445 HG21 HG21 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 75.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.58 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 75.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.55 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 75.13 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 73.13 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.576 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.408 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.445 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 74.4 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.4 ' HA ' HD11 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 63.43 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.447 ' HB2' HD12 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.55 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.5 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.402 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 73.33 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.488 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 75.11 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.45 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.468 HG13 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.21 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.496 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 74.24 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 70.44 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 75.33 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.538 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 74.42 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.462 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 73.42 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 73.04 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.523 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 71.02 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.462 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.25 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 74.41 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 73.21 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.45 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.417 HG12 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 71.34 110.88 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 75.22 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 64.04 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 72.12 111.667 176.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.438 ' HA ' HG21 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.5 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 74.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.477 ' HB ' HD13 ' B' ' 133' ' ' LEU . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 64.41 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 73.53 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 74.31 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -78.53 163.29 25.67 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.77 -40.13 40.29 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.976 0.91 . . . . 74.23 112.353 171.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.565 1.53 0 C-N-CA 124.04 0.936 . . . . 73.44 110.881 174.685 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 113.683 0.233 . . . . 64.41 113.683 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -141.76 -175.35 4.35 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.229 1.012 . . . . 74.14 111.434 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 59.59 -86.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.932 1.293 . . . . 75.31 112.632 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -76.31 -26.87 56.28 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.865 0.866 . . . . 75.11 110.781 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -83.24 87.47 6.94 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.688 0.795 . . . . 72.3 110.267 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.54 66.2 9.38 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.5 -0.773 . . . . 64.42 109.628 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -95.32 130.18 42.19 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 -169.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 74.42 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.533 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 75.54 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.533 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 65.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 72.24 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.545 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.539 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.731 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 71.14 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 74.43 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.723 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 74.43 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.445 HG22 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 75.24 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 73.11 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.583 ' HD3' HD23 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 75.42 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 62.15 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 63.12 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.47 HG11 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.588 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 74.31 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 73.13 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 64.35 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 62.11 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.588 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 74.22 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -71.55 -30.03 65.42 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 74.1 108.84 163.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.11 119.84 48.68 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 125.013 1.325 . . . . 71.51 109.631 166.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.01 -30.63 6.94 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.337 2.025 . . . . 74.43 113.082 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.477 ' HB2' HG22 ' B' ' 55' ' ' VAL . 13.0 m120 -76.93 -167.48 0.87 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.034 0.933 . . . . 64.4 112.378 -174.486 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.446 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.4 pt? -97.71 19.41 13.68 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.799 -0.563 . . . . 71.35 111.954 172.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.477 HG22 ' HB2' ' B' ' 53' ' ' ASN . 98.2 t -60.88 -57.82 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.353 0.661 . . . . 75.11 112.073 -174.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt -104.67 23.8 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 65.13 112.273 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 74.3 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 75.42 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 72.2 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.723 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 74.41 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 74.34 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.43 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 65.33 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 74.35 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 74.34 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.43 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.463 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 64.11 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.47 ' HB3' HG11 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 72.44 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 74.32 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 74.43 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 74.31 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 62.35 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 74.12 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.407 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 72.51 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 74.34 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.651 ' HB3' HD22 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.43 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 72.44 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.731 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 74.12 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.508 ' HA ' HG23 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 73.45 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 70.51 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.508 HG23 ' HA ' ' B' ' 91' ' ' TYR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 73.22 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.505 HG21 HG22 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 44.24 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 74.22 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 73.4 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 71.34 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 55.23 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 74.45 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.522 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 73.44 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.522 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 73.01 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 73.43 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.42 ' HG3' HG22 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 52.03 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 73.35 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.413 HD22 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 75.15 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.51 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 74.23 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 71.45 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.522 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.548 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 74.31 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.522 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.548 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 75.12 109.811 177.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.621 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 61.43 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 71.44 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.519 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 74.21 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.564 ' HA ' HG21 ' B' ' 134' ' ' THR . 1.5 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 75.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.517 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 73.43 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 72.0 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.564 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 71.4 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 73.12 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.577 ' HB3' ' HZ3' ' B' ' 140' ' ' LYS . 8.4 mtpm? -80.46 -171.45 3.06 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 75.24 111.892 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -49.36 -36.26 21.1 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.391 1.076 . . . . 74.53 113.217 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.76 0.824 . . . . 72.2 110.055 174.533 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.516 -0.233 . . . . 74.14 112.516 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 t -161.37 140.93 10.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.181 0.592 . . . . 73.52 111.55 177.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -87.0 -22.87 25.25 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.526 0.73 . . . . 72.41 110.726 171.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -69.74 -42.31 74.11 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.798 0.839 . . . . 72.45 111.152 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.8 97.16 3.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.916 0.487 . . . . 63.21 110.095 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.439 ' HB3' ' H ' ' A' ' 73' ' ' HIS . 8.9 m120 -91.55 126.13 36.53 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.983 0.913 . . . . 74.03 110.882 -174.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -76.04 135.76 39.93 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.323 0.582 . . . . 73.33 112.388 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -83.0 -21.1 34.0 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 124.076 0.95 . . . . 74.54 112.215 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 71.23 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 71.31 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 75.32 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 73.3 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.457 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 73.41 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.505 ' HD2' HD11 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 63.2 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 74.11 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.572 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 65.31 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.437 HG23 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG12 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 74.43 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 74.32 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.429 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.422 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.496 ' HG3' HG22 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.496 HG22 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.422 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 71.44 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 73.21 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 75.23 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 72.34 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 73.5 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.48 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 74.05 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.13 110.476 -179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 73.44 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 71.22 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 75.24 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 75.12 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m -88.78 6.78 37.2 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 74.33 112.87 174.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.472 ' HA ' HD13 ' A' ' 56' ' ' ILE . 2.9 m-20 -41.39 112.71 1.01 Allowed Pre-proline 0 N--CA 1.499 2.022 0 N-CA-C 114.81 1.411 . . . . 73.24 114.81 -177.124 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -75.75 -31.61 5.17 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.355 2.037 . . . . 74.43 111.575 167.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -142.98 139.83 30.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.389 1.076 . . . . 71.45 109.782 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -61.92 -0.57 0.5 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.567 1.321 . . . . 73.24 114.567 171.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 64.6 t -54.79 -29.31 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.631 0 C-N-CA 123.916 0.886 . . . . 70.14 112.352 171.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.472 HD13 ' HA ' ' A' ' 51' ' ' ASP . 30.7 pt -101.55 17.25 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 74.04 114.142 -174.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.42 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 74.15 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 73.02 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.519 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 75.31 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 74.01 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 75.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 75.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.55 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 75.13 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 73.13 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.439 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 74.4 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.476 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 63.43 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.572 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.476 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.55 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.5 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.414 ' HB3' HD22 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 73.33 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.408 ' HG3' HD23 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.437 HD21 HG12 ' A' ' 24' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.432 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 75.11 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.578 ' HB3' ' HZ1' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.45 112.862 177.911 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.448 HG22 ' HA ' ' A' ' 91' ' ' TYR . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.21 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 74.24 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 70.44 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 75.33 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 74.42 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 73.42 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 73.04 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.4 ' O ' ' HG3' ' A' ' 117' ' ' GLN . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 71.02 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 113' ' ' SER . 19.4 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.25 111.666 176.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 74.41 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.532 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 73.21 113.021 178.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.552 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.458 HG11 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.552 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 71.34 110.155 178.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.592 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 75.22 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 64.04 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 72.12 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG23 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.5 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.519 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 74.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.562 HG23 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 64.41 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 73.53 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.534 HD12 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 74.31 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.642 ' HD3' ' HB2' ' B' ' 142' ' ' ASP . 9.0 mtpm? -88.11 -168.35 2.18 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.43 -19.56 62.97 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.782 0.433 . . . . 74.23 111.771 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 CA--C 1.563 1.446 0 C-N-CA 123.709 0.804 . . . . 73.44 110.005 172.316 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.003 0 CA-C-O 120.271 -0.183 . . . . 64.41 113.205 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t -166.62 103.41 0.59 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.539 0.736 . . . . 74.14 110.46 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -92.54 -31.75 15.1 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.643 0.777 . . . . 75.31 111.742 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -100.94 -57.74 2.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.807 0.843 . . . . 75.11 112.56 -174.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.62 70.72 5.01 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.972 0.892 . . . . 72.3 111.799 -177.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.428 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 17.6 m120 -91.76 114.93 27.59 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.83 0.852 . . . . 64.42 110.129 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -66.78 132.63 48.46 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 -171.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.435 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 74.42 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 75.54 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.413 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 65.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 72.24 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.497 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.457 HG22 HD12 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 71.14 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 74.43 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.587 ' HD3' HG21 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.422 ' HB3' HD13 ' B' ' 49' ' ' LEU . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 74.43 112.111 -170.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.559 HG23 HD13 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 75.24 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.43 HD11 HD13 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 73.11 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.548 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 75.42 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 62.15 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.576 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 63.12 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.813 HD23 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 74.31 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 73.13 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 64.35 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.579 ' HB3' HG22 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 62.11 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.813 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.529 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.6 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.517 HG22 HG22 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.422 HD13 ' HB3' ' B' ' 28' ' ' SER . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 74.22 111.779 177.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t -81.69 7.83 11.44 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 74.1 112.968 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.67 135.95 48.81 Favored Pre-proline 0 CA--C 1.559 1.306 0 C-N-CA 123.908 0.883 . . . . 71.51 111.47 -177.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -79.66 -0.88 11.06 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.646 2.231 . . . . 74.43 112.767 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.465 ' HB3' HG22 ' B' ' 55' ' ' VAL . 82.4 m-20 -157.25 136.0 11.54 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.975 1.31 . . . . 64.4 110.007 -171.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.4 HD23 ' H ' ' B' ' 54' ' ' LEU . 0.6 OUTLIER -89.93 19.19 5.02 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.475 0.71 . . . . 71.35 111.421 178.245 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.465 HG22 ' HB3' ' B' ' 53' ' ' ASN . 84.5 t -56.64 -36.51 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 124.165 0.986 . . . . 75.11 111.014 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.429 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt -98.84 24.28 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 124.026 0.93 . . . . 65.13 112.7 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.515 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 74.3 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.497 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 75.42 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.429 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 72.2 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.515 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.587 HG21 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 74.41 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.517 HG22 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 74.34 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 65.33 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.579 HG22 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 74.35 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.43 HD13 HD11 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 74.34 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 64.11 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.441 ' O ' HG21 ' B' ' 77' ' ' VAL . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 72.44 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.454 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 74.32 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 74.43 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 74.31 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.434 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.434 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 62.35 110.673 178.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.594 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 74.12 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.497 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.532 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 72.51 110.331 175.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 74.34 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.594 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.43 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.409 ' HG3' HD23 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 72.44 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.457 HD12 HG22 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 74.12 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.46 ' HA ' HG21 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 73.45 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.565 ' HZ1' ' HB3' ' B' ' 93' ' ' LYS . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 70.51 112.03 -179.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.46 HG21 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 73.22 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.524 ' HB ' ' HZ3' ' B' ' 97' ' ' LYS . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 44.24 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.524 ' HZ3' ' HB ' ' B' ' 95' ' ' THR . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 74.22 111.611 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 73.4 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.423 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 71.34 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 55.23 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.497 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 74.45 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.485 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 73.44 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.411 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.519 HD11 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 73.01 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 73.43 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.576 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.519 ' HG3' HD11 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 52.03 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 73.35 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 75.15 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.416 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 74.23 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 71.45 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.428 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.48 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 74.31 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.48 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 75.12 110.151 176.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.452 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.592 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 61.43 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 71.44 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.516 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 74.21 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.45 HG21 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.608 ' HA ' HG23 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 75.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 73.43 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 72.0 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.608 HG23 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 71.4 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.534 ' HB2' HD12 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.443 HD12 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 73.12 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.508 ' HG2' ' H ' ' B' ' 141' ' ' ASP . 47.8 tttm -98.67 178.79 4.88 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 75.24 110.32 178.523 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . 0.508 ' H ' ' HG2' ' B' ' 140' ' ' LYS . 3.2 m-20 -43.43 -47.06 6.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 125.103 1.361 . . . . 74.53 111.586 167.777 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . 0.642 ' HB2' ' HD3' ' A' ' 140' ' ' LYS . 7.6 m-20 . . . . . 0 CA--C 1.557 1.216 0 C-N-CA 124.74 1.216 . . . . 72.2 110.978 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 CA-C-O 119.762 -0.465 . . . . 74.14 113.237 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m -60.82 102.59 0.2 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.985 0.914 . . . . 73.52 112.406 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -87.52 145.18 26.35 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.643 0.777 . . . . 72.41 111.376 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -94.82 -6.49 42.72 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.517 0.727 . . . . 72.45 112.821 -172.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -78.72 71.94 5.21 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.069 0.938 . . . . 63.21 110.187 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.7 114.74 28.74 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.13 0.972 . . . . 74.03 110.144 -176.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -86.83 86.36 7.32 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.222 1.01 . . . . 73.33 111.748 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -73.87 -12.68 60.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 115.851 -0.613 . . . . 74.54 111.675 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 71.23 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.512 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 71.31 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 75.32 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 73.3 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 73.41 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 63.2 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 74.11 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.518 HD22 HD13 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 65.31 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.574 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 74.43 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 74.32 110.644 -174.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.552 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.577 ' HB3' HD23 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.552 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 71.44 113.816 178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 73.21 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 75.23 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 72.34 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.441 ' HG3' HD13 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 73.5 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 74.05 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.412 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.13 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 73.44 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 71.22 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.574 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 75.24 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.574 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 75.12 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.516 HG21 HG22 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.445 HD13 ' HZ3' ' A' ' 60' ' ' LYS . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t -77.89 -1.15 30.38 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 74.33 112.879 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.579 ' HA ' HD11 ' A' ' 56' ' ' ILE . 0.8 OUTLIER -46.84 113.77 2.49 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 125.437 1.495 . . . . 73.24 113.052 -178.974 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.404 ' HD2' HD11 ' A' ' 56' ' ' ILE . 59.6 Cg_endo -68.53 -21.4 40.03 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.599 2.199 . . . . 74.43 111.631 171.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -154.65 153.4 31.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.095 1.358 . . . . 71.45 108.269 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -72.55 2.32 6.59 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 112.74 0.645 . . . . 73.24 112.74 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.77 -33.5 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 C-N-CA 124.615 1.166 . . . . 70.14 112.049 172.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.579 HD11 ' HA ' ' A' ' 51' ' ' ASP . 42.0 pt -103.54 23.81 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 C-N-CA 123.402 0.681 . . . . 74.04 112.447 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 74.15 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.477 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 73.02 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.576 HG21 ' HD3' ' A' ' 27' ' ' PRO . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 75.31 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 74.01 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.516 HG22 HG21 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.577 HD23 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 75.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 75.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.626 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.55 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 75.13 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 73.13 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG22 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.412 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.478 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 74.4 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.49 HG22 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 63.43 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.626 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.488 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.55 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.412 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.5 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.776 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.573 HD22 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.412 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.444 ' HB3' HD22 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 73.33 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.637 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.518 HD13 HD22 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 75.11 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.525 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.45 112.881 177.885 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.411 HG12 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.21 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 74.24 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 70.44 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.776 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 75.33 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.488 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.447 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.47 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 74.42 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.47 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 73.42 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.585 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 73.04 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.585 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 71.02 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.47 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.25 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.441 HD13 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.736 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 74.41 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 73.21 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.508 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.573 ' HG2' HD22 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.508 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 71.34 110.0 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.606 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 75.22 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 64.04 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 72.12 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.5 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 74.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 64.41 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.602 ' HB2' HD12 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 73.53 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 74.31 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.56 ' HZ2' ' HA ' ' A' ' 140' ' ' LYS . 0.1 OUTLIER -77.54 -149.7 0.04 OUTLIER 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 61.9 24.59 14.66 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.576 1.15 . . . . 74.23 110.338 -167.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.562 1.428 0 C-N-CA 125.095 1.358 . . . . 73.44 108.924 -170.989 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 CA-C-O 119.957 -0.357 . . . . 64.41 113.179 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -147.33 132.65 18.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.862 0.865 . . . . 74.14 110.676 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -89.73 161.04 16.26 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.686 0.794 . . . . 75.31 110.402 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -133.71 -48.91 0.82 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 122.998 0.519 . . . . 75.11 111.865 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.21 84.53 2.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.503 0.721 . . . . 72.3 112.358 -175.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -97.94 -161.1 0.85 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.798 0.839 . . . . 64.42 109.468 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.71 42.61 0.92 Allowed 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.464 0.706 . . . . 63.54 112.117 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.517 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 74.42 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' SER . . . . . 0.418 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.621 HD22 HD22 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.418 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 75.54 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.517 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 65.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 72.24 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.562 HD22 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.632 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.474 HG13 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 71.14 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.493 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 74.43 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.505 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 74.43 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.573 HG23 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 75.24 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.412 ' HB2' HD12 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 73.11 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 75.42 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.437 ' HB2' HD12 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 62.15 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 63.12 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.548 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.597 HD23 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 74.31 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 73.13 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 64.35 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.686 ' HB3' HG23 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 62.11 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.597 ' HB3' HD23 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.451 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.62 HG22 HG21 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.528 ' HA ' ' HZ3' ' B' ' 60' ' ' LYS . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 74.22 111.522 173.825 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t -99.59 9.19 43.61 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 74.1 111.829 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.639 ' HB3' HD13 ' B' ' 56' ' ' ILE . 7.3 m-20 -67.24 161.41 64.28 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.122 0.969 . . . . 71.51 112.679 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.22 -33.78 66.48 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 122.867 2.378 . . . . 74.43 114.014 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -155.39 163.87 39.49 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.652 0.781 . . . . 64.4 110.144 -174.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' B' ' 57' ' ' ARG . 2.5 pt? -84.24 -1.71 55.69 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.907 0.483 . . . . 71.35 111.992 170.049 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -58.77 -30.01 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.856 0.862 . . . . 75.11 111.666 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.639 HD13 ' HB3' ' B' ' 51' ' ' ASP . 18.8 pt -93.11 26.55 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 124.604 1.162 . . . . 65.13 112.61 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.644 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 74.3 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.442 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 75.42 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 72.2 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.644 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.632 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 74.41 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.62 HG21 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 74.34 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 65.33 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.686 HG23 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 74.35 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 74.34 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.503 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.675 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 64.11 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.675 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 72.44 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 74.32 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 74.43 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 74.31 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.621 HD22 HD22 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 62.35 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.415 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 74.12 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.492 HD22 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 72.51 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 74.34 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.567 ' HB3' HD22 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.43 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.43 ' HG3' HD23 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 72.44 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.567 HD22 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 74.12 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 73.45 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 70.51 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 73.22 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 44.24 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 74.22 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 73.4 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 71.34 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 55.23 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 74.45 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 73.44 113.062 177.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.454 HD13 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 73.01 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 73.43 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.454 ' HG2' HD13 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 52.03 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 73.35 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 75.15 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 74.23 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.437 HD12 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 71.45 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.736 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.634 ' SD ' HD22 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.426 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.492 ' HG2' HD22 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 74.31 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.497 HG23 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 75.12 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.606 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 61.43 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 71.44 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.481 ' HZ3' ' HB2' ' B' ' 128' ' ' LYS . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.447 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 74.21 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.464 HG22 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.449 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 75.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.466 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 73.43 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 72.0 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.449 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 71.4 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.544 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.602 HD12 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 73.12 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.621 ' HZ2' ' HB3' ' B' ' 140' ' ' LYS . 9.6 mtpm? -104.6 -51.64 3.04 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 75.24 111.073 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 81.15 -47.8 0.25 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 126.369 1.868 . . . . 74.53 111.718 -173.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 CA--C 1.571 1.752 0 C-N-CA 123.045 0.538 . . . . 72.2 112.121 -178.417 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.475 -0.25 . . . . 74.14 112.475 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.9 p -122.15 106.65 11.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 117.53 0.665 . . . . 73.52 110.752 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -102.38 154.94 18.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.71 0.804 . . . . 72.41 111.889 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -73.4 -17.71 61.23 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.362 0.875 . . . . 72.45 113.362 -174.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -60.81 149.67 35.15 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.742 0.817 . . . . 63.21 112.531 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -92.88 39.28 1.04 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 123.973 0.909 . . . . 74.03 110.747 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -72.1 133.91 45.48 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 121.617 0.722 . . . . 73.33 112.834 -173.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.447 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 -81.0 -22.84 39.12 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.632 0.773 . . . . 74.54 112.853 -172.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 71.23 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 71.31 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 75.32 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 73.3 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.595 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 73.41 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.595 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 63.2 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 74.11 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.404 ' HA ' HD11 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 65.31 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.561 HG23 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.598 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.514 HG13 HD23 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 74.43 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 74.32 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.518 ' HD3' HG23 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.614 HD13 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.606 HG23 HD12 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 71.44 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 73.21 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 75.23 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 72.34 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 73.5 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 74.05 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.41 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.606 HD12 HG23 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.13 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 73.44 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 71.22 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.6 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 75.24 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 75.12 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.634 ' NE2' HG11 ' A' ' 48' ' ' VAL . 1.5 pp0? -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.67 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -97.65 0.6 47.48 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 74.33 111.974 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -107.51 132.89 20.65 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.907 0.883 . . . . 73.24 111.455 -171.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -82.38 11.23 3.25 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 123.119 2.546 . . . . 74.43 113.811 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.58 ' HB3' HG23 ' A' ' 55' ' ' VAL . 18.3 m120 -144.15 139.84 29.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.408 0.683 . . . . 71.45 110.744 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -80.19 1.16 29.37 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 123.626 0.77 . . . . 73.24 112.18 167.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.58 HG23 ' HB3' ' A' ' 53' ' ' ASN . 77.1 t -55.95 -43.32 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.514 0.726 . . . . 70.14 112.21 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt -93.82 23.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 C-N-CA 123.74 0.816 . . . . 74.04 112.958 -178.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.598 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 74.15 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.67 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 73.02 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.561 ' HB ' HG23 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 75.31 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 74.01 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.509 HD11 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 75.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.6 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 75.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.55 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 75.13 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 73.13 111.107 173.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.447 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.41 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.466 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 74.4 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 63.43 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.55 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.5 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.608 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 73.33 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.42 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.514 HD23 HG13 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.471 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.522 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 75.11 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.45 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.52 HG21 HG22 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.21 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.52 HG22 HG21 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 74.24 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.425 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.522 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.608 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 70.44 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 75.33 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.427 ' O ' HD11 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.633 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 74.42 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.411 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 73.42 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.668 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 73.04 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.668 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.456 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 71.02 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.411 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.456 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.25 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.687 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 74.41 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 73.21 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.542 ' HA ' ' HE3' ' A' ' 124' ' ' MET . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.542 ' HE3' ' HA ' ' A' ' 121' ' ' THR . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 71.34 110.108 179.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 75.22 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 64.04 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.529 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 72.12 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.622 ' HA ' HG23 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.5 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 74.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.622 HG23 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 64.41 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.711 ' HB2' HD12 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 73.53 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.622 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 74.31 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.469 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm -85.86 158.41 19.96 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -66.29 -42.45 88.38 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 124.35 1.06 . . . . 74.23 112.122 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 CA--C 1.563 1.46 0 C-N-CA 123.471 0.708 . . . . 73.44 110.734 172.35 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 CA-C-O 120.085 -0.286 . . . . 64.41 112.701 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -152.98 164.99 36.94 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.786 0.835 . . . . 74.14 110.804 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -155.43 150.06 26.27 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.025 0.93 . . . . 75.31 111.142 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -86.7 -29.11 22.68 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.388 0.885 . . . . 75.11 113.388 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.76 152.37 41.64 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 118.115 0.416 . . . . 72.3 110.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.448 ' ND2' ' HG3' ' B' ' 74' ' ' LYS . 9.5 m120 -69.43 -93.02 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 CA-C-O 118.451 -0.785 . . . . 64.42 111.348 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 61.99 148.08 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 173.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 74.42 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.575 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 75.54 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.575 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 65.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 72.24 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.412 HG11 HD23 ' B' ' 90' ' ' LEU . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 71.14 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.645 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 74.43 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.805 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 74.43 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.491 HG21 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 75.24 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 73.11 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 75.42 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 62.15 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 63.12 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.518 ' HB ' HG23 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.555 HD23 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 74.31 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 73.13 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 64.35 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.483 ' O ' HG23 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 62.11 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.555 ' HB3' HD23 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.433 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.483 HG23 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 74.22 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t -80.7 -0.43 38.31 Favored 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 74.1 112.643 -176.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.631 ' HB3' ' HZ2' ' B' ' 60' ' ' LYS . 2.6 p-10 -80.58 144.72 57.27 Favored Pre-proline 0 CA--C 1.558 1.261 0 C-N-CA 123.733 0.813 . . . . 71.51 111.344 -175.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -80.24 -6.77 13.95 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.902 2.401 . . . . 74.43 113.951 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -147.13 135.35 21.61 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.312 0.645 . . . . 64.4 109.848 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.486 HD22 ' H ' ' B' ' 54' ' ' LEU . 2.0 pt? -78.38 1.54 21.65 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.972 0.509 . . . . 71.35 111.517 172.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 38.9 t -65.72 -41.28 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.236 1.014 . . . . 75.11 110.953 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.444 HD13 ' HB2' ' B' ' 51' ' ' ASP . 37.9 pt -84.96 17.57 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 CA-C-N 115.73 -0.668 . . . . 65.13 112.634 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.516 ' O ' HG21 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 74.3 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 75.42 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 72.2 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.631 ' HZ2' ' HB3' ' B' ' 51' ' ' ASP . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.805 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 74.41 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.425 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.48 ' HB2' HG13 ' B' ' 48' ' ' VAL . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 74.34 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 65.33 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.456 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 74.35 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 74.34 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.518 HG23 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 64.11 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.448 ' HG3' ' ND2' ' B' ' 6' ' ' ASN . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 72.44 111.524 175.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 74.32 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 74.43 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 74.31 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.441 ' O ' HD12 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.417 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . 0.508 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.431 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 62.35 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.645 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 74.12 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.508 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 72.51 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . 0.431 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 74.34 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.477 ' HB3' HD21 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.43 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 72.44 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.477 HD21 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 74.12 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.534 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 73.45 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.418 ' HD3' HD12 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 70.51 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.431 HG11 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 73.22 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 44.24 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 74.22 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 73.4 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.534 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 71.34 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 55.23 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 74.45 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.468 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 73.44 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.546 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.511 HG21 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 73.01 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 73.43 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.511 ' HG3' HG21 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 52.03 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 73.35 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.546 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 75.15 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 74.23 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 71.45 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.687 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.676 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 74.31 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.676 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 75.12 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 61.43 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 71.44 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.569 ' HA ' HE21 ' B' ' 131' ' ' GLN . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.504 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 74.21 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.408 HG21 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.569 HE21 ' HA ' ' B' ' 128' ' ' LYS . 27.5 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 75.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 73.43 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 72.0 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.504 HG23 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 71.4 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.622 ' HB2' HD12 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.711 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 73.12 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.469 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm -81.08 164.05 22.72 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 75.24 112.524 -170.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -65.35 -7.15 12.22 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.599 1.16 . . . . 74.53 113.761 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.568 1.65 0 C-N-CA 123.785 0.834 . . . . 72.2 112.034 178.773 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.035 0 CA-C-O 120.332 -0.149 . . . . 74.14 112.943 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -78.35 176.78 9.01 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.246 0.618 . . . . 73.52 111.066 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.87 119.93 8.1 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.829 0.852 . . . . 72.41 113.028 -172.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -95.88 -49.72 5.19 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.242 1.017 . . . . 72.45 111.271 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -70.98 124.98 25.61 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.034 0.534 . . . . 63.21 111.995 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -124.44 97.08 5.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.696 1.198 . . . . 74.03 111.006 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.456 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 31.3 t70 -81.31 75.54 8.27 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.545 1.165 . . . . 73.33 111.056 177.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -80.36 -13.49 59.12 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.032 -0.986 . . . . 74.54 111.01 170.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 71.23 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 71.31 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 75.32 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 73.3 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 73.41 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 63.2 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 74.11 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 65.31 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.58 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 74.43 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.4 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 74.32 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.715 ' HD3' HG22 ' A' ' 61' ' ' VAL . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.7 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.614 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 71.44 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.404 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 73.21 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.413 HD13 HD12 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 75.23 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 72.34 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 73.5 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.441 ' HG ' ' HB ' ' A' ' 106' ' ' ILE . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 74.05 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.534 HG11 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.614 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.13 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 73.44 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 71.22 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 75.24 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.457 ' HB3' HD23 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 75.12 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p -60.62 -25.41 66.25 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 74.33 110.487 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -114.11 107.32 52.11 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.331 1.052 . . . . 73.24 108.949 163.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.5 -36.9 14.1 Favored 'Trans proline' 0 CA--C 1.565 2.042 0 C-N-CA 122.066 1.844 . . . . 74.43 113.049 171.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -93.24 -161.37 0.84 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 123.71 0.804 . . . . 71.45 112.908 -173.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.537 HD21 ' H ' ' A' ' 54' ' ' LEU . 2.6 pt? -88.66 13.57 11.98 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.477 1.111 . . . . 73.24 113.42 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.9 t -60.77 -57.15 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 112.463 0.542 . . . . 70.14 112.463 -167.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -116.81 27.42 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.445 0.698 . . . . 74.04 112.569 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.671 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.534 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 74.15 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.671 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 73.02 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.715 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 75.31 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 74.01 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.418 HG21 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.413 HD12 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 75.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.436 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 75.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.55 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 75.13 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 73.13 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.456 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG2' HG11 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 74.4 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 63.43 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.437 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.55 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . 0.402 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.5 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.402 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' HD22 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 73.33 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.472 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.472 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 75.11 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.475 ' HD3' HD12 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.45 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.21 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 74.24 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 70.44 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 75.33 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.437 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 74.42 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.468 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 73.42 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 73.04 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.415 ' HA ' ' HB ' ' A' ' 116' ' ' THR . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 71.02 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.468 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.415 ' HB ' ' HA ' ' A' ' 113' ' ' SER . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.25 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 74.41 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.467 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 73.21 111.831 178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.409 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.425 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.409 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 71.34 110.24 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 75.22 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 64.04 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.433 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 72.12 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.584 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.2 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.5 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 74.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.584 HG21 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 64.41 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.604 ' HB2' HD12 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 73.53 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 74.31 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -103.13 154.25 19.49 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.09 -32.71 74.33 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.281 0.632 . . . . 74.23 112.292 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.568 1.668 0 C-N-CA 123.861 0.864 . . . . 73.44 110.996 -178.221 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 120.672 0.04 . . . . 64.41 113.185 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -83.77 -42.6 16.34 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.244 0.618 . . . . 74.14 112.096 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.01 116.05 9.93 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.164 0.586 . . . . 75.31 111.288 -176.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -81.11 -24.16 37.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.25 0.62 . . . . 75.11 110.531 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -70.38 89.04 0.67 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.42 0.688 . . . . 72.3 111.193 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -87.05 93.24 9.31 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.886 0.851 . . . . 64.42 109.216 170.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -88.2 38.59 0.86 Allowed 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 -173.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 74.42 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 75.54 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 65.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.556 HG23 ' HZ2' ' B' ' 93' ' ' LYS . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 72.24 111.104 177.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.611 HD23 HD11 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.463 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.728 HG13 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 71.14 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.409 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 74.43 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.549 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 74.43 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.409 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.415 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD11 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 75.24 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.435 HD11 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 73.11 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 75.42 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.413 ' HG3' HD22 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 62.15 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.585 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 63.12 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.461 HD13 HD23 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 74.31 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 73.13 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 64.35 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 62.11 111.912 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 74.22 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -96.85 -22.04 17.14 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 74.1 109.525 168.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.427 ' HB2' HD12 ' B' ' 56' ' ' ILE . 23.7 t70 -53.4 140.47 45.55 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 126.101 1.76 . . . . 71.51 111.852 168.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -39.82 -70.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 123.668 2.912 . . . . 74.43 113.309 169.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -135.0 -87.18 0.38 Allowed 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 118.735 0.698 . . . . 64.4 112.839 175.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 pp -126.77 38.03 4.18 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.298 0.851 . . . . 71.35 113.298 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 13.3 t -86.57 -57.7 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.711 0.805 . . . . 75.11 112.682 -169.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.534 HD11 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp -98.3 31.48 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 65.13 113.61 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.455 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 74.3 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 75.42 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 72.2 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.549 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.476 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 74.41 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.418 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 74.34 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 65.33 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 74.35 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.461 HD23 HD13 ' B' ' 40' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 74.34 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 64.11 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 72.44 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 74.32 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 74.43 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 74.31 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 62.35 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.426 HD11 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 74.12 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.467 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 72.51 110.463 176.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 74.34 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.548 ' HB3' HD22 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . 0.461 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.43 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.563 ' HG3' HD23 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 72.44 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.728 HD21 HG13 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 74.12 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.499 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 73.45 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.556 ' HZ2' HG23 ' B' ' 20' ' ' THR . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 70.51 112.842 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 73.22 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 44.24 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 74.22 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 73.4 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.499 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 71.34 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 55.23 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 74.45 110.858 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 73.44 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.445 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 73.01 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 73.43 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.585 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 52.03 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.405 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 73.35 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.445 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 75.15 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 74.23 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.413 HD22 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 71.45 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.501 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.598 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 74.31 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.501 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.598 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 75.12 110.736 -176.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 61.43 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . 0.453 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 71.44 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.547 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 74.21 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.509 HG22 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG21 ' B' ' 134' ' ' THR . 2.6 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 75.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 73.43 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 72.0 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.604 HG21 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 71.4 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.604 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 73.12 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.54 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? -105.04 -167.12 1.3 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 75.24 111.46 -174.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -123.87 21.25 9.13 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.249 0.619 . . . . 74.53 112.217 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 . . . . . 0 N--CA 1.492 1.641 0 C-N-CA 123.362 0.665 . . . . 72.2 112.125 -176.437 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.901 0 CA-C-O 120.476 -0.069 . . . . 74.14 112.974 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.2 t -154.79 31.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.669 0.747 . . . . 73.52 110.663 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -152.71 -78.44 0.11 Allowed 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 115.461 -0.79 . . . . 72.41 112.311 -170.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -110.0 -61.56 1.64 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.648 -0.657 . . . . 72.45 112.491 -172.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -88.29 171.14 10.4 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 112.486 0.55 . . . . 63.21 112.486 -175.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -95.21 153.08 17.83 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 123.716 0.806 . . . . 74.03 111.181 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -121.23 111.53 17.51 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.548 0.739 . . . . 73.33 111.287 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -81.28 -38.87 26.14 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.064 0.945 . . . . 74.54 112.6 -175.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 71.23 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.482 ' HZ3' HD21 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 71.31 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.514 ' HB ' ' HH ' ' A' ' 76' ' ' TYR . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 75.32 111.022 172.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 73.3 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 73.41 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.524 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 63.2 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 74.11 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.524 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 65.31 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.539 HG13 HD23 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 74.43 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.522 HD12 HD21 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 74.32 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.47 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.732 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.47 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 71.44 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 73.21 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.453 HD13 HD12 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 75.23 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 72.34 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD13 ' A' ' 118' ' ' LEU . 14.9 mm100 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 73.5 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 74.05 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.13 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 73.44 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . 0.435 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 71.22 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 75.24 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 75.12 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.445 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t -90.03 -8.26 51.97 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 74.33 112.798 -175.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -78.62 145.67 67.67 Favored Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 123.761 0.824 . . . . 73.24 112.406 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.21 -2.09 9.37 Favored 'Trans proline' 0 CA--C 1.565 2.033 0 C-N-CA 123.14 2.56 . . . . 74.43 114.683 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' A' ' 55' ' ' VAL . 38.2 m-80 -151.67 141.86 22.3 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-N 118.734 0.697 . . . . 71.45 110.964 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.505 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 2.7 pt? -74.76 -0.9 19.73 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.624 0.77 . . . . 73.24 112.637 173.359 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.495 HG23 ' HB3' ' A' ' 53' ' ' ASN . 42.4 t -63.46 -32.01 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.82 0.848 . . . . 70.14 112.012 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.434 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp -98.63 28.85 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.395 1.078 . . . . 74.04 113.556 -173.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.47 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 74.15 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.434 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 73.02 111.433 179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.732 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 75.31 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 74.01 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.453 HD12 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.482 HD21 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 75.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.431 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 75.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.55 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 75.13 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 73.13 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.514 ' HH ' ' HB ' ' A' ' 13' ' ' VAL . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 74.4 112.706 171.539 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' HD11 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 63.43 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.441 HD11 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.492 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.55 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.5 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.611 ' HB3' HD21 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 73.33 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.611 HD21 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 75.11 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.45 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.21 112.618 175.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.639 ' HB ' ' HZ3' ' A' ' 97' ' ' LYS . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 74.24 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.639 ' HZ3' ' HB ' ' A' ' 95' ' ' THR . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 70.44 109.869 162.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 75.33 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.492 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 74.42 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 73.42 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 73.04 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 71.02 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.25 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.555 HD13 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 74.41 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 73.21 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.467 ' HA ' ' HE1' ' A' ' 124' ' ' MET . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.467 ' HE1' ' HA ' ' A' ' 121' ' ' THR . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 71.34 110.552 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.762 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 75.22 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.487 ' HZ1' ' HB2' ' A' ' 128' ' ' LYS . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 64.04 110.931 173.801 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 72.12 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.478 ' HA ' HG23 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.5 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.401 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 74.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.478 HG23 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 64.41 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 73.53 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.567 HD12 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 74.31 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -86.55 150.31 24.33 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 63.28 15.28 8.51 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.867 1.267 . . . . 74.23 111.941 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 124.214 1.006 . . . . 73.44 111.819 -176.696 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 112.838 -0.105 . . . . 64.41 112.838 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 30.5 t -83.11 73.82 10.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.576 0.703 . . . . 74.14 109.427 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -124.33 140.28 53.1 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.087 0.955 . . . . 75.31 110.426 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.49 -44.19 12.92 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.127 -0.694 . . . . 75.11 109.127 170.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.98 128.49 44.58 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.156 0.982 . . . . 72.3 110.344 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -78.23 105.41 9.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.843 0.457 . . . . 64.42 110.616 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.57 130.86 35.38 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 74.42 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.489 HD23 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.476 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 75.54 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.468 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.476 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 65.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 72.24 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.587 HD21 HD11 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.472 HG13 HD23 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 71.14 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 74.43 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.581 ' HB3' HD23 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 74.43 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.449 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 75.24 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 73.11 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 75.42 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 62.15 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 63.12 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.665 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 74.31 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 73.13 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 64.35 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 62.11 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.665 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.453 HG12 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 74.22 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -79.78 1.21 27.6 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 74.1 111.769 170.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.655 ' HB3' ' HE3' ' B' ' 60' ' ' LYS . 6.8 p-10 -72.89 128.29 88.29 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 122.605 0.362 . . . . 71.51 111.606 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -80.92 5.73 6.01 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 C-N-CA 122.669 2.246 . . . . 74.43 112.768 167.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.476 ' HB2' HG21 ' B' ' 55' ' ' VAL . 0.3 OUTLIER -165.43 144.86 6.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.689 0.796 . . . . 64.4 111.89 -175.835 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.47 HD22 ' H ' ' B' ' 54' ' ' LEU . 1.3 pt? -80.0 1.73 26.44 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.92 0.488 . . . . 71.35 112.096 176.308 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.476 HG21 ' HB2' ' B' ' 53' ' ' ASN . 39.4 t -58.92 -35.12 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.869 0.867 . . . . 75.11 111.615 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.2 pp -109.93 24.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.835 0.854 . . . . 65.13 112.352 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 74.3 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 75.42 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 72.2 111.94 178.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.655 ' HE3' ' HB3' ' B' ' 51' ' ' ASP . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.486 HG23 ' HD3' ' B' ' 27' ' ' PRO . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 74.41 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.581 HD23 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 74.34 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 65.33 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 74.35 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 74.34 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 64.11 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.598 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 72.44 111.448 176.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.453 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 74.32 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.46 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 74.43 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 74.31 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.489 HD21 HD23 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 62.35 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 74.12 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 72.51 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 74.34 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.401 ' HB3' HD21 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.43 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 72.44 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.587 HD11 HD21 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 74.12 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 73.45 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.578 ' HB2' ' HZ1' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 70.51 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.446 HG12 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 73.22 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 44.24 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 74.22 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 73.4 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 71.34 113.251 170.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 55.23 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 74.45 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.445 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 73.44 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.598 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.445 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 73.01 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 73.43 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.408 ' HG3' HG21 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 52.03 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 73.35 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 75.15 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 74.23 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 71.45 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.603 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.461 ' O ' HG21 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.544 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 74.31 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.461 HG21 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.544 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 75.12 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.762 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 61.43 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 71.44 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.469 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 74.21 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.43 HG22 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.558 ' HA ' HG23 ' B' ' 134' ' ' THR . 22.7 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 75.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.48 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 73.43 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 72.0 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.558 HG23 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 71.4 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.567 ' HB2' HD12 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.494 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 73.12 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -114.97 -45.99 2.94 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 75.24 111.565 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.32 -55.61 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.441 -1.254 . . . . 74.53 110.624 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 CA--C 1.565 1.525 0 C-N-CA 123.38 0.672 . . . . 72.2 110.303 178.423 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.042 0 CA-C-O 119.751 -0.472 . . . . 74.14 112.492 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -90.07 131.78 35.76 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 117.562 0.681 . . . . 73.52 110.672 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -76.22 108.72 9.34 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.533 0.683 . . . . 72.41 111.045 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.35 -67.12 0.77 Allowed 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 115.627 -0.715 . . . . 72.45 109.206 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -125.59 -44.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 107.766 -1.198 . . . . 63.21 107.766 165.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -51.97 124.35 12.57 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.787 1.235 . . . . 74.03 111.419 171.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -127.62 29.69 5.45 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 111.803 0.298 . . . . 73.33 111.803 -168.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.09 -50.38 69.31 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.294 1.037 . . . . 74.54 113.655 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 71.23 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 71.31 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 75.32 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 73.3 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 73.41 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 74.11 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.461 ' HB2' ' HA ' ' A' ' 18' ' ' ARG . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 65.31 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.687 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.65 HG13 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 74.43 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.431 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 74.32 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.548 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.548 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 71.44 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 73.21 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 75.23 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 72.34 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 73.5 112.002 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 74.05 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.526 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.13 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 73.44 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 71.22 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.412 ' HB2' ' HG ' ' A' ' 40' ' ' LEU . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 75.24 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.423 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 75.12 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.677 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.483 HD23 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -84.52 -4.2 58.82 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 74.33 110.885 171.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -48.96 130.29 14.99 Favored Pre-proline 0 CA--C 1.568 1.637 0 C-N-CA 124.609 1.163 . . . . 73.24 113.378 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.674 ' HD2' HD13 ' A' ' 56' ' ' ILE . 85.3 Cg_endo -75.47 -7.98 19.16 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 122.801 2.334 . . . . 74.43 113.11 174.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -174.17 164.77 4.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.366 1.066 . . . . 71.45 110.532 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -66.04 -14.41 61.66 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.58 0.956 . . . . 73.24 113.58 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.59 -57.31 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.801 0.841 . . . . 70.14 111.968 -171.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.674 HD13 ' HD2' ' A' ' 52' ' ' PRO . 2.6 pp -79.51 3.53 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 74.04 113.108 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.416 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.687 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 74.15 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.677 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 73.02 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.426 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 75.31 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 74.01 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.428 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.403 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 75.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.444 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 75.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.55 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 75.13 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.479 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 73.13 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 74.4 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 63.43 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.562 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.55 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.5 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' HD22 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 73.33 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.45 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.521 ' HG3' HD23 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.65 HD21 HG13 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.562 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.58 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 75.11 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.466 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.45 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.21 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 74.24 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.58 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 70.44 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.4 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 75.33 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.509 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 74.42 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 73.42 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 112' ' ' GLU . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 73.04 112.614 -176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.523 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 71.02 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.25 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 74.41 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.472 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 73.21 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 71.34 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 75.22 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.41 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 64.04 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.474 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.403 HG21 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 72.12 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG23 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.5 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 74.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.604 HG23 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 64.41 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD13 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 73.53 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.587 HD13 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 74.31 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm -77.14 157.01 31.23 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 72.25 0.98 3.78 Favored 'General case' 0 CA--C 1.566 1.593 0 C-N-CA 125.388 1.475 . . . . 74.23 111.967 -174.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 73.44 110.413 -179.939 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 CA-C-O 120.056 -0.302 . . . . 64.41 112.69 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -140.19 120.28 13.72 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.243 0.545 . . . . 74.14 111.143 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -97.6 116.98 30.86 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.678 1.191 . . . . 75.31 110.225 173.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -88.56 -29.56 19.95 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 113.663 0.986 . . . . 75.11 113.663 -169.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.85 154.38 30.2 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.721 0.409 . . . . 72.3 111.181 176.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -65.94 105.22 1.27 Allowed 'General case' 0 N--CA 1.484 1.27 0 CA-C-O 120.906 0.384 . . . . 64.42 110.581 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -96.76 89.95 5.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.559 0.744 . . . . 63.54 112.764 -169.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.404 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 74.42 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.414 HD22 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 75.54 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.428 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 65.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 72.24 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.485 HD22 HD11 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.514 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.768 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.458 HG13 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 71.14 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.438 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 74.43 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.587 ' HD3' HG21 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.497 ' HB2' HD13 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 74.43 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.438 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.545 ' HA ' HD13 ' B' ' 40' ' ' LEU . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 75.24 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 73.11 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 75.42 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 62.15 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.404 ' HG2' ' HB2' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 63.12 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.545 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 74.31 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 73.13 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . 0.405 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 64.35 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.5 ' O ' HG23 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 62.11 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.401 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.618 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.497 HD13 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 74.22 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t -81.21 0.99 34.15 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 74.1 112.372 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -81.6 142.56 49.77 Favored Pre-proline 0 CA--C 1.562 1.424 0 C-N-CA 123.415 0.686 . . . . 71.51 110.8 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -87.35 5.45 5.63 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.245 2.63 . . . . 74.43 113.432 177.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -172.43 159.57 4.62 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.956 0.902 . . . . 64.4 111.254 -171.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.07 25.45 0.29 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.845 1.054 . . . . 71.35 113.845 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 96.0 t -76.46 -55.45 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.712 -0.618 . . . . 75.11 111.231 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt -95.7 10.14 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 65.13 113.518 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.488 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 74.3 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.768 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 75.42 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 72.2 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.618 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.587 HG21 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 74.41 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.409 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 74.34 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 65.33 110.339 174.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . 0.581 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 74.35 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 74.34 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 64.11 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 72.44 111.101 174.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.423 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 74.32 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.491 ' HA ' HD13 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 74.43 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 74.31 112.639 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.51 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.491 HD13 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.51 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 62.35 109.3 173.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 74.12 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 72.51 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 74.34 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.452 ' HB3' HD22 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.43 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD23 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 72.44 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.555 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 74.12 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 73.45 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.616 ' HZ3' ' HB2' ' B' ' 93' ' ' LYS . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 70.51 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.481 HG23 HG22 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 73.22 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.481 HG22 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 44.24 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 74.22 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 73.4 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 71.34 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 55.23 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 74.45 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.442 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 73.44 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.492 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 73.01 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 73.43 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.404 ' HB2' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.492 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 52.03 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.447 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 73.35 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 75.15 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.447 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 74.23 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.433 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 71.45 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.567 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 74.31 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.567 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 75.12 110.958 179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.701 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 61.43 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 71.44 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 74.21 111.314 173.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG23 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 75.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 73.43 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 72.0 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.533 HG23 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 71.4 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.587 ' HB2' HD13 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 73.12 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -97.39 -81.59 0.43 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 75.24 111.538 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.27 17.17 22.51 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.027 0.931 . . . . 74.53 111.054 -175.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.568 0.747 . . . . 72.2 111.22 -179.788 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 CA-C-O 120.23 -0.205 . . . . 74.14 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 t 59.71 -148.39 0.46 Allowed 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.267 1.027 . . . . 73.52 110.972 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.04 157.52 38.07 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.499 0.59 . . . . 72.41 110.675 171.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.35 -10.02 59.26 Favored 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 114.135 1.161 . . . . 72.45 114.135 -170.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.93 102.03 0.56 Allowed 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.673 0.669 . . . . 63.21 111.898 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -158.65 103.14 1.73 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 107.758 -1.201 . . . . 74.03 107.758 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -64.11 130.66 44.84 Favored 'General case' 0 CA--C 1.557 1.22 0 N-CA-C 113.303 0.853 . . . . 73.33 113.303 -162.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.6 -34.93 30.67 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.562 1.145 . . . . 74.54 111.638 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 71.23 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 71.31 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 75.32 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 73.3 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 73.41 112.893 -177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.532 ' HG2' HD11 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 63.2 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 74.11 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.47 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 65.31 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.486 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.592 HG13 HD23 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 74.43 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.47 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 74.32 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.706 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.51 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.53 HG22 HD12 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 71.44 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 73.21 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.459 HD11 HD22 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 75.23 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 72.34 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.419 ' HG3' HD13 ' A' ' 118' ' ' LEU . 14.3 mm100 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 73.5 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.511 ' HG2' ' HB2' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 74.05 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.49 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.53 HD12 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.13 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 73.44 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 71.22 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 75.24 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 75.12 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -120.03 -30.79 4.61 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 74.33 111.049 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -92.14 134.14 29.05 Favored Pre-proline 0 CA--C 1.569 1.691 0 C-N-CA 123.605 0.762 . . . . 73.24 111.441 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -91.68 40.01 0.31 Allowed 'Trans proline' 0 CA--C 1.563 1.953 0 C-N-CA 123.49 2.793 . . . . 74.43 113.811 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.47 ' HB3' HG21 ' A' ' 55' ' ' VAL . 15.7 m120 -152.37 163.95 38.47 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 123.213 0.605 . . . . 71.45 111.653 -167.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.537 ' H ' HD22 ' A' ' 54' ' ' LEU . 1.9 pt? -104.06 25.65 9.72 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.611 0.597 . . . . 73.24 112.611 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.47 HG21 ' HB3' ' A' ' 53' ' ' ASN . 75.9 t -70.33 -56.81 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.358 0.663 . . . . 70.14 111.521 -179.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -98.71 23.73 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 123.867 0.867 . . . . 74.04 111.751 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.706 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.486 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 74.15 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.557 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 73.02 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.51 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 75.31 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 74.01 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.419 HD11 HD11 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.532 HD11 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 75.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.506 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 75.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.459 HD22 HD11 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.55 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 75.13 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 73.13 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.49 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 74.4 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 63.43 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.55 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.476 HD22 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.5 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.587 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.414 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . 0.414 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.408 ' HB3' HD21 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 73.33 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.609 HD12 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 75.11 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.609 ' HD3' HD12 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.45 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.21 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 74.24 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 70.44 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.587 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 75.33 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.403 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.482 ' HE3' ' HD2' ' A' ' 74' ' ' LYS . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 74.42 111.233 176.398 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 73.42 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.502 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.511 ' HB2' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 73.04 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.502 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 71.02 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.25 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.419 HD13 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.565 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 74.41 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.412 ' HA ' ' HE3' ' A' ' 120' ' ' MET . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 73.21 113.039 176.453 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.502 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.451 HG11 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.502 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 71.34 110.63 178.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 125' ' ' LYS . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.451 ' NE2' HD22 ' B' ' 126' ' ' LEU . 9.7 tp-100 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 75.22 111.321 176.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 64.04 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.475 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 72.12 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG21 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.5 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 74.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.542 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.494 HG21 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 64.41 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD13 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 73.53 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 74.31 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.408 ' HD2' HD21 ' B' ' 137' ' ' LEU . 63.9 tttm -99.96 -70.95 0.72 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -98.62 -30.28 12.57 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.058 -0.974 . . . . 74.23 110.727 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 CA--C 1.563 1.466 0 C-N-CA 123.422 0.689 . . . . 73.44 110.269 173.342 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.048 0 N-CA-C 112.975 -0.05 . . . . 64.41 112.975 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' SER . . . . . 0.677 ' HB2' ' HB2' ' B' ' 5' ' ' GLU . 66.2 m -89.86 154.19 20.07 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.695 0.798 . . . . 74.14 111.706 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.97 -61.25 2.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.588 1.155 . . . . 75.31 112.339 -172.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -82.87 -26.53 31.49 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.388 0.675 . . . . 75.11 111.617 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . 0.677 ' HB2' ' HB2' ' B' ' 2' ' ' SER . 41.3 mt-10 -78.56 76.27 5.07 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.589 0.709 . . . . 72.3 111.416 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -137.27 106.16 5.94 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.353 1.461 . . . . 64.42 107.946 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -65.81 123.69 20.45 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 -167.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . 0.469 ' HZ3' HD21 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 74.42 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.433 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 75.54 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.433 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 65.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 72.24 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.555 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.426 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.563 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.672 HG11 HD23 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 71.14 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.495 HD12 HD12 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 74.43 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.518 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 74.43 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.473 HG22 HD12 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 75.24 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 73.11 112.113 176.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 75.42 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 62.15 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 63.12 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.473 HD12 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 74.31 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 73.13 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 64.35 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 62.11 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.518 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 74.22 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.61 -34.33 75.47 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 74.1 111.064 173.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -124.76 81.14 61.57 Favored Pre-proline 0 CA--C 1.565 1.543 0 C-N-CA 124.721 1.208 . . . . 71.51 110.153 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.91 -5.78 12.81 Favored 'Trans proline' 0 N--CA 1.511 2.54 0 C-N-CA 123.657 2.905 . . . . 74.43 115.484 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -63.53 149.11 47.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.432 1.093 . . . . 64.4 112.896 -172.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.51 HD22 ' H ' ' B' ' 54' ' ' LEU . 1.2 pt? -91.39 7.28 41.85 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 112.521 0.563 . . . . 71.35 112.521 177.189 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.53 -48.16 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 122.257 1.027 . . . . 75.11 110.169 172.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp -110.22 24.69 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 CA-C-N 113.483 -1.689 . . . . 65.13 111.175 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 74.3 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.563 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 75.42 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 72.2 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.574 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 74.41 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.468 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 74.34 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.469 HD21 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 65.33 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.468 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 74.35 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.426 HD21 HD11 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 74.34 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 64.11 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.57 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 72.44 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.4 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 74.32 111.565 173.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 74.43 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 74.31 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 62.35 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.495 HD12 HD12 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 74.12 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 72.51 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 74.34 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD21 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.43 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 72.44 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.672 HD23 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 74.12 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.487 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 73.45 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 70.51 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.438 HG12 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 73.22 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 44.24 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 74.22 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.481 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 73.4 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.487 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 71.34 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 55.23 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 74.45 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.635 ' HD2' HD22 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 73.44 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.412 HG22 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.587 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 73.01 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 73.43 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' SER . . . . . 0.42 ' HG ' ' HA3' ' B' ' 114' ' ' GLY . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . 0.587 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 52.03 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 73.35 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . 0.42 ' HA3' ' HG ' ' B' ' 110' ' ' SER . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.635 HD22 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 75.15 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 74.23 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 71.45 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.565 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.425 ' HA ' ' HE1' ' B' ' 124' ' ' MET . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 74.31 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.51 HG21 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.425 ' HE1' ' HA ' ' B' ' 121' ' ' THR . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 75.12 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 61.43 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 71.44 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.4 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 74.21 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.428 HG21 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.703 ' HA ' HG21 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 75.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 73.43 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 72.0 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.703 HG21 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 71.4 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.544 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.572 HD13 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 73.12 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -61.52 158.95 13.86 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 75.24 112.892 171.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 65.78 8.41 5.24 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.921 1.289 . . . . 74.53 112.783 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.426 0 C-N-CA 124.136 0.974 . . . . 72.2 110.118 -178.435 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 CA-C-O 120.45 -0.083 . . . . 74.14 113.13 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.2 m -88.23 123.2 32.61 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.236 0.615 . . . . 73.52 111.469 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -105.44 -159.89 0.73 Allowed 'General case' 0 CA--C 1.564 1.489 0 C-N-CA 123.773 0.829 . . . . 72.41 110.676 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -132.83 -43.27 0.9 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.819 0.848 . . . . 72.45 111.732 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.78 128.4 36.28 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.428 0.899 . . . . 63.21 113.428 -167.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -79.42 87.52 5.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.514 0.673 . . . . 74.03 109.283 168.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.44 113.93 6.42 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 115.261 -0.881 . . . . 73.33 113.212 -169.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.67 -19.37 41.79 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 71.23 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 71.31 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 75.32 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.458 HD22 HD23 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 73.3 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 73.41 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 63.2 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.597 HG23 ' HZ1' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 74.11 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.435 ' HA ' HD11 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 65.31 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.738 HG12 HD22 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 74.43 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.534 HD13 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 74.32 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.723 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.521 ' HG3' HG21 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.56 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.551 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 71.44 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 73.21 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 75.23 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 72.34 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.465 ' HB2' HD13 ' A' ' 118' ' ' LEU . 14.6 mm100 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 73.5 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.404 ' HG ' ' HB ' ' A' ' 106' ' ' ILE . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 74.05 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.509 HG11 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.551 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.13 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 73.44 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 71.22 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.413 ' HB2' HG12 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 75.24 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 75.12 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.723 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.78 -34.81 75.06 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 74.33 111.281 172.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.42 ' HB2' HD13 ' A' ' 56' ' ' ILE . 3.3 p-10 -119.96 87.64 38.96 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.239 1.016 . . . . 73.24 110.44 173.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.62 -9.74 26.42 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.945 2.43 . . . . 74.43 115.02 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -70.3 146.47 50.55 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.172 0.804 . . . . 71.45 113.172 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -76.02 -12.74 60.19 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.481 1.113 . . . . 73.24 112.076 176.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.0 t -60.49 -36.46 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.783 0.833 . . . . 70.14 111.067 -175.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.42 HD13 ' HB2' ' A' ' 51' ' ' ASP . 6.3 pt -116.88 26.61 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.51 1.124 . . . . 74.04 111.625 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.571 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 74.15 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.546 ' HG3' HG12 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 73.02 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.651 HG21 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 75.31 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 74.01 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 75.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.413 HG12 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 75.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.55 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 75.13 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 73.13 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.509 ' HB3' HG11 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 74.4 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 63.43 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.467 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.526 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.48 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.55 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.466 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.5 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.499 ' HA ' ' HE3' ' B' ' 120' ' ' MET . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 73.33 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.477 ' HG3' HD21 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.738 HD22 HG12 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.41 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.634 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 75.11 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.597 ' HZ1' HG23 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.45 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.469 HG12 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.21 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 74.24 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.433 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.634 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 70.44 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 75.33 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.467 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 74.42 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.445 HG23 HD11 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 73.42 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 73.04 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 71.02 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.445 HD11 HG23 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.25 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.465 HD13 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.629 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 74.41 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.489 ' HE2' ' HG ' ' B' ' 85' ' ' LEU . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 73.21 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.609 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.484 HG12 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.609 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 71.34 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.45 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 75.22 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 64.04 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.54 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.479 HG22 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 72.12 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.685 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.5 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 74.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.685 HG21 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 64.41 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.569 ' HB2' HD12 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 73.53 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.436 HD12 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 74.31 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.559 ' HE2' HD22 ' B' ' 137' ' ' LEU . 91.6 mttt -108.22 132.34 53.75 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t70 176.62 -31.29 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 125.158 1.383 . . . . 74.23 110.354 -173.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.49 1.559 0 C-N-CA 124.033 0.933 . . . . 73.44 111.921 -172.58 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.441 -0.264 . . . . 64.41 112.441 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.6 m -87.96 106.55 18.2 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.618 0.767 . . . . 74.14 109.879 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.8 145.64 55.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.153 0.581 . . . . 75.31 111.043 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -93.73 -56.26 2.96 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.933 0.493 . . . . 75.11 111.956 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.31 161.77 21.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.016 0.927 . . . . 72.3 112.704 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.459 HD22 ' HB3' ' B' ' 69' ' ' GLN . 54.6 t-20 -72.37 95.01 1.69 Allowed 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.593 -0.73 . . . . 64.42 109.083 171.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -79.74 83.48 5.69 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 74.42 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.421 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 75.54 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 65.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 72.24 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.473 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' SER . . . . . 0.433 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 71.14 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 74.43 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.659 ' HD3' HG23 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 74.43 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.422 HD11 HD22 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.572 HG22 HD13 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 75.24 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 73.11 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 75.42 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.486 ' HB2' HD13 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 62.15 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.501 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 63.12 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.417 HG11 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.572 HD13 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 74.31 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 73.13 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 64.35 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.446 ' HA ' ' HG2' ' B' ' 47' ' ' GLN . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 62.11 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.446 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.446 HG22 HD21 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.446 HD21 HG22 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 74.22 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t -60.08 -34.23 73.16 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 74.1 110.957 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -108.7 111.53 60.99 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 123.928 0.891 . . . . 71.51 109.009 162.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -54.52 -32.65 74.87 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 123.232 2.621 . . . . 74.43 113.996 177.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -95.06 -176.79 3.93 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.403 0.681 . . . . 64.4 110.865 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.445 HD13 HH11 ' B' ' 57' ' ' ARG . 0.7 OUTLIER -97.25 69.78 2.3 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 121.568 0.699 . . . . 71.35 111.451 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 54.5 t -92.07 -58.08 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.908 -0.495 . . . . 75.11 110.605 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.9 pp -97.17 27.5 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 C-N-CA 123.741 0.816 . . . . 65.13 111.651 175.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.445 HH11 HD13 ' B' ' 54' ' ' LEU . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 74.3 115.34 -172.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.473 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 75.42 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 72.2 110.721 173.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.519 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.659 HG23 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 74.41 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.432 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 74.34 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.468 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 65.33 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.523 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 74.35 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.432 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 74.34 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.523 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 64.11 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.471 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 72.44 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 74.32 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 74.43 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 74.31 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 62.35 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 74.12 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.489 ' HG ' ' HE2' ' A' ' 120' ' ' MET . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 72.51 111.046 176.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 74.34 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.43 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 72.44 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.442 ' O ' HG12 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 74.12 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 73.45 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 70.51 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.504 HG21 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 73.22 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.504 HG23 HG21 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 44.24 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 74.22 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 73.4 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 71.34 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 55.23 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.433 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 74.45 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.402 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 73.44 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.471 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.535 HG21 HD11 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.402 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 73.01 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 73.43 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.501 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 52.03 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 73.35 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.535 HD11 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 75.15 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 74.23 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 71.45 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.629 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.499 ' HE3' ' HA ' ' A' ' 85' ' ' LEU . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.425 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 74.31 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.444 HG11 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 75.12 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 61.43 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 71.44 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 74.21 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.466 HG11 HD13 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.527 ' HA ' HG21 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 75.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.451 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 73.43 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 72.0 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.527 HG21 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 71.4 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.569 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 73.12 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.466 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt -113.48 179.92 3.82 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 75.24 111.079 171.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 69.98 12.9 7.89 Favored 'General case' 0 CA--C 1.569 1.675 0 C-N-CA 124.117 0.967 . . . . 74.53 111.928 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.492 1.642 0 C-N-CA 123.263 0.625 . . . . 72.2 112.119 -178.552 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 CA-C-O 119.652 -0.527 . . . . 74.14 113.51 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -89.92 76.45 7.09 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.724 0.762 . . . . 73.52 111.337 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.66 123.3 23.78 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.334 0.654 . . . . 72.41 110.83 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -87.25 -41.32 13.78 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 72.45 111.87 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.79 84.95 6.2 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.101 0.56 . . . . 63.21 110.678 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -73.18 95.3 2.07 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.211 0.605 . . . . 74.03 110.839 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.495 ' HB3' ' N ' ' A' ' 73' ' ' HIS . 13.5 t70 -90.54 69.37 6.78 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 122.343 1.068 . . . . 73.33 109.647 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.57 -16.32 52.01 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 114.64 -1.164 . . . . 74.54 111.99 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 71.23 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.424 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 71.31 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 75.32 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 73.3 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 73.41 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 63.2 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 74.11 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 65.31 111.319 179.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.492 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.704 HG13 HD22 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 74.43 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.56 HD12 HD12 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 74.32 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.552 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.442 ' HB3' HD13 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.558 HG23 HD12 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 71.44 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 73.21 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.445 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 75.23 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 72.34 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.502 ' HB3' HD12 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 73.5 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 74.05 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.558 HD12 HG23 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.13 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 73.44 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 71.22 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 75.24 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 75.12 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.552 HG23 HG22 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.701 HD11 ' HZ3' ' A' ' 60' ' ' LYS . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -86.75 6.43 31.45 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 74.33 112.92 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.519 ' HA ' HD13 ' A' ' 56' ' ' ILE . 1.9 m-20 -41.46 108.62 0.59 Allowed Pre-proline 0 N--CA 1.496 1.827 0 C-N-CA 126.082 1.753 . . . . 73.24 114.592 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.42 -29.14 88.1 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.558 2.172 . . . . 74.43 112.559 168.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -155.7 156.13 34.38 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 125.385 1.474 . . . . 71.45 109.864 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -64.27 -9.3 16.59 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.216 0.821 . . . . 73.24 113.216 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 57.7 t -54.18 -40.35 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.079 0.952 . . . . 70.14 112.014 178.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.519 HD13 ' HA ' ' A' ' 51' ' ' ASP . 40.6 pt -88.27 15.26 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 74.04 113.614 -174.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 74.15 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.701 ' HZ3' HD11 ' A' ' 49' ' ' LEU . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 73.02 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.552 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 75.31 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 74.01 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.552 HG22 HG23 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.441 HD13 ' HG3' ' A' ' 18' ' ' ARG . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 75.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 75.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.55 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 75.13 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 73.13 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.495 ' N ' ' HB3' ' A' ' 7' ' ' ASP . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.482 ' CZ ' HD13 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 74.4 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 63.43 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.482 HD13 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.55 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.56 HD12 HD12 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.5 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 73.33 111.533 -177.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.41 ' HG3' HD21 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.704 HD22 HG13 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.491 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.455 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 75.11 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.45 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.21 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.59 ' HB ' ' HZ1' ' A' ' 97' ' ' LYS . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 74.24 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.59 ' HZ1' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 70.44 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 75.33 121.139 -164.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.488 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 74.42 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.502 HD12 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 73.42 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 73.04 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 71.02 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.25 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.53 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 74.41 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.495 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 73.21 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.504 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.504 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 71.34 109.694 -176.535 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 75.22 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 64.04 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.481 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 72.12 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.566 ' HA ' HG21 ' A' ' 134' ' ' THR . 2.8 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.5 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.498 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 74.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.566 HG21 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 64.41 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.578 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 73.53 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 74.31 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.608 ' HB3' ' HZ2' ' A' ' 140' ' ' LYS . 9.5 mtpm? -99.77 172.68 7.11 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -85.08 -58.09 2.83 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.333 -0.848 . . . . 74.23 111.03 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 . . . . . 0 CA--C 1.575 1.925 0 C-N-CA 125.447 1.499 . . . . 73.44 114.289 -174.012 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 CA-C-O 120.012 -0.326 . . . . 64.41 113.054 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -142.89 17.1 1.96 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.348 0.659 . . . . 74.14 112.226 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.8 169.96 13.51 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.983 0.513 . . . . 75.31 112.122 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -55.14 -52.12 64.3 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.585 0.754 . . . . 75.11 112.253 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -88.99 -29.04 19.8 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.471 0.708 . . . . 72.3 112.113 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -58.95 102.04 0.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.28 0.562 . . . . 64.42 110.768 -175.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -94.43 64.96 3.18 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 -172.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 74.42 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 75.54 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 65.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.529 HG23 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 72.24 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.503 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.654 HG11 HD22 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 71.14 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.501 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 74.43 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.723 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 74.43 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.466 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 75.24 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 73.11 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 75.42 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 62.15 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 63.12 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.466 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 74.31 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.42 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 8.7 m-80 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 73.13 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . 0.467 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 64.35 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 62.11 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.424 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 74.22 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -63.79 -37.41 87.27 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 74.1 112.448 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.67 152.55 51.85 Favored Pre-proline 0 CA--C 1.562 1.435 0 C-N-CA 123.883 0.873 . . . . 71.51 111.179 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -96.24 37.65 0.13 Allowed 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 123.449 2.766 . . . . 74.43 114.39 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.481 ' HB3' HG21 ' B' ' 55' ' ' VAL . 93.5 m-20 -140.24 144.09 36.32 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 113.217 0.821 . . . . 64.4 113.217 -167.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.527 ' HB2' ' HD2' ' B' ' 57' ' ' ARG . 1.7 pt? -91.32 4.8 51.46 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.634 -0.712 . . . . 71.35 111.933 168.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . 0.481 HG21 ' HB3' ' B' ' 53' ' ' ASN . 49.9 t -56.51 -43.15 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.673 0.789 . . . . 75.11 111.31 176.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -107.23 22.54 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 124.458 1.103 . . . . 65.13 111.927 -176.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.527 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 74.3 112.83 -172.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 75.42 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 72.2 111.528 174.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.723 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.494 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 74.41 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.413 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.4 HD21 ' HB3' ' B' ' 27' ' ' PRO . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 74.34 111.956 179.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 65.33 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.413 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 74.35 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 74.34 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 64.11 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.438 ' O ' HG22 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 72.44 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.416 ' CZ ' HD13 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 74.32 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.438 HG22 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 74.43 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 74.31 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.508 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 62.35 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 74.12 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 72.51 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 74.34 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.496 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.43 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 72.44 111.299 -179.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.654 HD22 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 74.12 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.508 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 73.45 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.529 ' NZ ' HG23 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 70.51 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.44 HG23 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 73.22 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.413 HG23 HG22 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 44.24 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 74.22 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 73.4 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.496 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 71.34 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 55.23 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 74.45 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.403 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 73.44 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 104' ' ' SER . . . . . 0.409 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.409 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 73.01 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 73.43 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 52.03 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 73.35 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 75.15 111.874 178.232 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 74.23 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 71.45 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.53 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.464 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.492 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 74.31 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.481 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.464 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 75.12 110.475 -178.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.492 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 61.43 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 71.44 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 74.21 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.47 HG21 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.714 ' HA ' HG21 ' B' ' 134' ' ' THR . 1.4 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 75.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 73.43 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 72.0 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.714 HG21 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 71.4 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.578 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 73.12 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.544 ' HB3' ' HZ3' ' B' ' 140' ' ' LYS . 9.6 mtpm? -92.59 178.08 5.92 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 75.24 110.896 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -126.4 62.27 1.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.832 0.825 . . . . 74.53 109.459 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 . . . . . 0 CA--C 1.567 1.601 0 CA-C-N 115.128 -0.942 . . . . 72.2 111.407 172.018 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 CA-C-O 120.361 -0.133 . . . . 74.14 113.322 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 p -158.04 -73.04 0.09 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.191 0.596 . . . . 73.52 109.97 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 67.87 -1.61 1.66 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 116.118 1.896 . . . . 72.41 116.118 165.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -91.25 -46.04 8.28 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 118.195 0.452 . . . . 72.45 110.868 175.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -82.33 72.11 9.39 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 121.748 0.785 . . . . 63.21 110.449 178.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -74.55 -59.0 2.93 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.855 -1.066 . . . . 74.03 112.09 -175.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -147.68 17.05 1.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 112.972 0.731 . . . . 73.33 112.972 -170.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.448 ' HB3' ' NE2' ' A' ' 69' ' ' GLN . 4.8 p-10 -57.92 -19.77 32.39 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 71.23 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.441 ' HZ3' HD23 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 71.31 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 75.32 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 73.3 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 73.41 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.591 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 63.2 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.458 HG22 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 74.11 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.439 HD11 HG13 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 65.31 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.509 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.67 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 74.43 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 74.32 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.621 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.43 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.62 HG21 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 71.44 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 73.21 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 75.23 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 72.34 111.216 170.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 73.5 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 74.05 112.85 172.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG21 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.13 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 73.44 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 71.22 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.412 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 75.24 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.609 ' HB3' HD23 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 75.12 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 9.9 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t -70.61 -33.87 71.5 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 74.33 109.531 170.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.97 106.56 43.35 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.164 1.386 . . . . 73.24 108.147 171.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -63.02 -23.17 73.97 Favored 'Trans proline' 0 N--CA 1.504 2.094 0 C-N-CA 122.926 2.417 . . . . 74.43 115.093 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.35 175.22 10.03 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.742 0.817 . . . . 71.45 112.626 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.607 ' HB2' ' HD3' ' A' ' 57' ' ' ARG . 2.2 pt? -100.95 17.68 21.62 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.018 0.527 . . . . 73.24 112.126 -171.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.53 -55.1 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.394 0.678 . . . . 70.14 111.375 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt -107.94 25.24 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.546 0.738 . . . . 74.04 112.27 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.607 ' HD3' ' HB2' ' A' ' 54' ' ' LEU . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.466 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 74.15 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.404 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 73.02 112.634 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.509 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 75.31 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 74.01 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.621 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 75.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 75.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.55 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.448 ' NE2' ' HB3' ' A' ' 8' ' ' ASP . 53.2 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 75.13 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 73.13 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . 0.444 ' O ' HG22 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.515 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 74.4 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.444 HG22 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 63.43 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.55 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.626 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.5 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 73.33 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD23 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.67 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.626 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 75.11 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.463 ' HZ2' ' HB3' ' A' ' 93' ' ' LYS . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.45 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.591 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.21 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.444 ' OG1' ' HG2' ' A' ' 97' ' ' LYS . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 74.24 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.459 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.568 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.568 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 70.44 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.465 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 75.33 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 74.42 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 73.42 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 73.04 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.432 ' HA ' HD13 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 71.02 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.25 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.639 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 74.41 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG21 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 73.21 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.6 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.6 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 71.34 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.586 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 75.22 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 64.04 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.417 HG21 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 72.12 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.531 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.5 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 74.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 64.41 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.57 ' HB2' HD13 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 73.53 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.554 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 74.31 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.13 168.57 11.86 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -101.65 6.37 41.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.002 0.521 . . . . 74.23 111.749 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 124.064 0.946 . . . . 73.44 111.733 -170.594 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 113.888 0.315 . . . . 64.41 113.888 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -71.77 -54.97 8.51 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.446 0.698 . . . . 74.14 111.52 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.25 157.39 19.32 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.469 0.707 . . . . 75.31 111.337 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -94.67 -48.98 5.83 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.113 0.965 . . . . 75.11 110.128 178.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -72.65 98.86 2.43 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 121.215 0.531 . . . . 72.3 111.196 178.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -159.94 171.93 18.49 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.121 0.968 . . . . 64.42 110.277 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -106.04 90.32 3.33 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . 0.429 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 74.42 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.42 HD23 HD22 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 75.54 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 65.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.468 HG23 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 72.24 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.665 HD23 HD13 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.55 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.484 HG12 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 71.14 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.447 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 74.43 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.626 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 74.43 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.484 HG21 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 75.24 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 73.11 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 75.42 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.648 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 62.15 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.608 ' HG2' ' HB2' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 63.12 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.489 HG13 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.484 HD11 HG21 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 74.31 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 73.13 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 64.35 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 62.11 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.447 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.583 HG23 HG21 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.532 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 74.22 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -79.31 -28.81 42.17 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 74.1 108.913 163.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -124.78 116.01 26.44 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 125.279 1.431 . . . . 71.51 108.983 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.19 -10.8 17.76 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 122.502 2.135 . . . . 74.43 112.529 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.54 -179.02 7.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.007 0.923 . . . . 64.4 111.05 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.565 HD22 ' H ' ' B' ' 54' ' ' LEU . 2.5 pt? -94.7 15.62 17.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 112.358 0.503 . . . . 71.35 112.358 178.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -66.62 -45.31 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.076 0.55 . . . . 75.11 111.624 -174.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -119.37 26.61 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 65.13 112.715 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.494 ' HD3' ' HB2' ' B' ' 54' ' ' LEU . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 74.3 113.312 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.55 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 75.42 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 72.2 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.626 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.51 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 74.41 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.583 HG21 HG23 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.537 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 74.34 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 65.33 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 74.35 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 74.34 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 64.11 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.489 ' HB3' HG13 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 72.44 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.429 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 74.32 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 74.43 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 74.31 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.533 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . 0.507 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 62.35 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 74.12 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.532 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 72.51 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 74.34 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.573 ' HB3' HD22 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.43 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 72.44 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.665 HD13 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 74.12 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.465 ' HA ' HG21 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 73.45 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.55 ' HB3' ' HZ2' ' B' ' 93' ' ' LYS . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 70.51 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.465 HG21 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 73.22 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 44.24 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 74.22 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 73.4 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.445 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 71.34 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 55.23 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 74.45 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.532 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 73.44 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.489 HG22 HD12 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 73.01 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 73.43 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.608 ' HB2' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 52.03 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 73.35 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.489 HD12 HG22 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 75.15 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 116' ' ' THR . . . . . 0.472 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 74.23 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.648 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 71.45 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.639 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.472 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.58 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 74.31 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 75.12 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.586 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 61.43 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 71.44 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 74.21 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.401 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.48 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 75.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 73.43 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 72.0 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.48 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 71.4 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.554 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.57 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 73.12 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -78.72 167.01 21.84 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 75.24 112.615 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.03 -22.52 36.4 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-N 114.623 -1.171 . . . . 74.53 111.225 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.566 1.584 0 C-N-CA 123.775 0.83 . . . . 72.2 111.51 177.631 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 CA-C-O 119.8 -0.445 . . . . 74.14 112.322 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 m -157.73 164.64 36.89 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.68 0.792 . . . . 73.52 111.209 177.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -93.1 -75.52 0.49 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.249 0.62 . . . . 72.41 111.175 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -94.52 -22.38 18.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.918 0.887 . . . . 72.45 111.994 -173.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -61.47 134.09 56.48 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.363 0.665 . . . . 63.21 112.353 -178.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -84.58 11.49 8.73 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 123.636 0.774 . . . . 74.03 111.986 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -56.63 135.89 54.83 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.891 1.276 . . . . 73.33 113.625 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 -82.15 -13.45 57.18 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 122.857 0.463 . . . . 74.54 111.766 167.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 71.23 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 71.31 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 75.32 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 73.3 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 73.41 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.418 ' HA ' HD11 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 63.2 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 74.11 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.588 HD22 HD13 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 65.31 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.481 ' HB2' ' HZ1' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.493 HG11 HD22 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 74.43 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 74.32 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.642 ' HB3' HD23 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.481 HG21 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 71.44 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.433 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 73.21 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 75.23 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 72.34 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 12.8 mm100 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 73.5 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 74.05 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.591 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.13 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 73.44 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 71.22 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 75.24 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.591 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 75.12 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.577 HG22 HG11 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -60.63 -33.67 73.13 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 74.33 111.406 174.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -93.82 108.33 34.01 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 123.424 0.69 . . . . 73.24 110.556 170.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -72.08 -27.13 17.41 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.594 2.196 . . . . 74.43 112.982 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -73.16 142.59 47.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.184 0.593 . . . . 71.45 112.26 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.607 ' HB2' ' HD2' ' A' ' 57' ' ' ARG . 2.2 pt? -77.66 2.04 17.97 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.533 0.733 . . . . 73.24 112.629 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -53.73 -50.28 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 124.088 0.955 . . . . 70.14 112.025 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt -107.31 22.6 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 74.04 112.497 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.63 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.481 ' HZ1' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 74.15 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 73.02 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 75.31 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 74.01 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.577 HG11 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.642 HD23 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 75.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.43 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 75.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.55 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 75.13 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 73.13 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.442 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 74.4 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 63.43 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.453 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.55 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.596 HD12 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.5 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.401 HD22 ' HG2' ' A' ' 122' ' ' GLU . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.609 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 73.33 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.609 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.444 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.421 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 75.11 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD12 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.45 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.562 HG22 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.21 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.562 HG23 HG22 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 74.24 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 70.44 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.519 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 75.33 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.519 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.509 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 74.42 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.487 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 73.42 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.648 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 73.04 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.648 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.42 ' HA ' ' HB ' ' A' ' 116' ' ' THR . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 71.02 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.487 ' HB2' HD13 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.25 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 74.41 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.464 ' O ' HG23 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 73.21 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.538 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.401 ' HG2' HD22 ' A' ' 85' ' ' LEU . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.538 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 71.34 109.955 177.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 75.22 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 64.04 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.448 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 72.12 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.456 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.5 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.47 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 74.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.456 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 64.41 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 73.53 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 74.31 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -77.62 146.12 36.35 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 60.86 7.03 1.33 Allowed 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 125.049 1.339 . . . . 74.23 113.383 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 123.064 0.546 . . . . 73.44 110.83 -172.031 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.033 0 N-CA-C 112.782 -0.127 . . . . 64.41 112.782 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -120.81 90.99 3.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.63 0.772 . . . . 74.14 109.877 177.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -98.86 148.37 24.0 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.552 0.741 . . . . 75.31 110.694 -177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -109.88 95.69 5.76 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.994 0.918 . . . . 75.11 109.674 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -107.0 166.48 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.653 -1.158 . . . . 72.3 112.206 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -104.97 21.91 16.2 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.414 1.086 . . . . 64.42 110.457 171.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -66.26 128.98 38.25 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.402 1.081 . . . . 63.54 113.293 -168.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 74.42 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 75.54 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 65.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 72.24 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.422 ' HA ' HD11 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.526 HG23 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.602 HG11 HD22 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 71.14 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . 0.422 HD11 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 74.43 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.481 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 74.43 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.502 HH11 ' HB3' ' B' ' 86' ' ' TYR . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.487 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.479 HG23 HD12 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 75.24 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 HD22 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 73.11 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 75.42 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.445 ' HG3' HD13 ' B' ' 118' ' ' LEU . 12.7 mm100 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 62.15 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.569 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 63.12 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . 0.482 HG13 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.607 HD11 HD12 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 74.31 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 73.13 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 64.35 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 62.11 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.554 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 74.22 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t -68.04 -4.31 12.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 74.1 112.452 170.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -133.39 84.25 47.19 Favored Pre-proline 0 CA--C 1.56 1.332 0 C-N-CA 124.192 0.997 . . . . 71.51 109.64 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -77.03 -21.15 12.44 Favored 'Trans proline' 0 CA--C 1.56 1.782 0 C-N-CA 122.764 2.309 . . . . 74.43 112.937 174.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -86.74 19.24 3.01 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.651 0.78 . . . . 64.4 113.092 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.655 ' HB2' ' HD2' ' B' ' 57' ' ' ARG . 0.6 OUTLIER 39.31 43.01 0.88 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 126.031 1.732 . . . . 71.35 115.146 175.729 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.43 -45.21 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.507 0.723 . . . . 75.11 110.494 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -120.98 24.96 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.582 1.153 . . . . 65.13 112.134 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.655 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 74.3 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.48 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 75.42 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 72.2 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.481 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.526 ' HB ' HG23 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 74.41 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . 0.607 HD12 HD11 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 74.34 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 65.33 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 74.35 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.478 HD22 HD12 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 74.34 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.576 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 64.11 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.576 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 72.44 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 74.32 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 74.43 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 74.31 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . 0.508 ' HA ' ' HG ' ' B' ' 82' ' ' SER . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.519 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' SER . . . . . 0.508 ' HG ' ' HA ' ' B' ' 79' ' ' PHE . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 62.35 110.737 175.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.456 HD22 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 74.12 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.439 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 72.51 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . 0.502 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 74.34 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.466 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.43 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 72.44 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.602 HD22 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 74.12 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.593 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 73.45 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.575 ' HD3' HD12 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 70.51 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 73.22 112.309 174.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 44.24 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 74.22 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 73.4 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.593 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 71.34 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 55.23 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . 0.439 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 74.45 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 73.44 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.457 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 73.01 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 73.43 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.569 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 52.03 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 73.35 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 75.15 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 74.23 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.445 HD13 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 71.45 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.638 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.58 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 74.31 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.58 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 75.12 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.723 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 61.43 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 71.44 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.443 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 74.21 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.46 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 75.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.484 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 73.43 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 72.0 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.46 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 71.4 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.524 ' HB2' HD13 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 73.12 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -105.24 -72.89 0.7 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 75.24 110.647 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -115.66 9.63 15.31 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.423 1.089 . . . . 74.53 109.941 172.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 CA--C 1.562 1.438 0 C-N-CA 124.747 1.219 . . . . 72.2 108.905 -173.705 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 CA-C-O 120.441 -0.088 . . . . 74.14 112.954 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -88.26 107.83 19.0 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.168 0.587 . . . . 73.52 110.948 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -91.95 139.32 30.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.307 0.643 . . . . 72.41 111.048 174.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -69.85 -33.28 72.06 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.281 0.632 . . . . 72.45 110.95 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -119.96 121.81 39.8 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.887 0.875 . . . . 63.21 111.074 -173.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.97 155.84 30.56 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.155 0.582 . . . . 74.03 110.155 167.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.433 ' O ' ' SG ' ' A' ' 10' ' ' CYS . 3.6 p-10 -85.94 74.3 10.17 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-O 122.958 1.361 . . . . 73.33 110.531 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.472 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 -80.03 -12.64 59.68 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 115.178 -0.919 . . . . 74.54 111.412 173.844 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 71.23 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' ' O ' ' A' ' 7' ' ' ASP . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.487 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.449 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 71.31 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 75.32 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 73.3 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.527 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 73.41 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 0.423 ' HB2' HG13 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 63.2 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.455 HG23 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 74.11 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.485 HD21 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 65.31 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.722 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.542 HG13 HD23 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 74.43 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 74.32 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.468 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.488 HG23 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 71.44 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.415 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 73.21 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 75.23 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 72.34 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 73.5 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 74.05 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.488 HD11 HG23 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.13 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 73.44 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 71.22 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.565 ' HA ' HE21 ' A' ' 47' ' ' GLN . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 75.24 112.043 -174.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 75.12 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.612 HE22 HD13 ' A' ' 67' ' ' ILE . 4.6 pp0? -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t -120.38 8.67 10.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 74.33 109.856 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -76.13 140.23 69.57 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 124.981 1.313 . . . . 73.24 111.833 -177.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -86.56 9.22 4.09 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.98 2.453 . . . . 74.43 113.623 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 175.91 165.52 0.38 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.487 1.115 . . . . 71.45 108.345 -169.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.3 mt -95.39 37.06 1.2 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.528 0.731 . . . . 73.24 112.017 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.13 -43.46 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 123.4 0.68 . . . . 70.14 111.05 -177.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt -90.13 27.45 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 74.04 113.224 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.722 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 74.15 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.533 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 73.02 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.471 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 75.31 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 74.01 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.415 HD21 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.487 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 75.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.612 HD13 HE22 ' A' ' 47' ' ' GLN . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 75.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.55 111.411 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . 0.472 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 75.13 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 73.13 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.638 ' HG3' ' HE3' ' A' ' 105' ' ' MET . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.406 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 74.4 110.751 169.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.601 ' HA ' HD13 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 63.43 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.601 HD13 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.55 110.851 171.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.5 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.544 ' HG ' HG23 ' B' ' 123' ' ' VAL . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.559 ' HB3' HD21 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 73.33 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.559 HD21 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.522 ' HH ' HG22 ' A' ' 102' ' ' VAL . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . 0.611 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 75.11 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.491 ' HB2' ' HZ2' ' A' ' 93' ' ' LYS . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.45 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.62 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.21 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.62 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 74.24 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.611 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 70.44 112.301 167.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.522 HG22 ' HH ' ' A' ' 91' ' ' TYR . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 75.33 111.919 -169.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.521 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.638 ' HE3' ' HG3' ' A' ' 74' ' ' LYS . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 74.42 110.988 176.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.405 ' O ' HD12 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 73.42 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.442 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 73.04 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.442 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 71.02 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.25 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.719 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 74.41 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.585 ' HE3' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 73.21 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.568 ' HA ' ' HE1' ' A' ' 124' ' ' MET . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.415 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.568 ' HE1' ' HA ' ' A' ' 121' ' ' THR . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 71.34 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.598 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 75.22 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 124' ' ' MET . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 64.04 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.48 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 72.12 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.567 ' HA ' HG21 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.5 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 74.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.567 HG21 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 64.41 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.633 ' HB2' HD13 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 73.53 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.594 HD13 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 74.31 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.94 163.46 15.57 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 59.81 20.49 9.34 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.588 1.155 . . . . 74.23 112.867 -176.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.574 1.871 0 C-N-CA 124.448 1.099 . . . . 73.44 112.591 -178.537 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 114.182 0.433 . . . . 64.41 114.182 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -152.04 30.85 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.909 0.883 . . . . 74.14 110.002 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.88 105.62 2.04 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.772 0.829 . . . . 75.31 111.225 -174.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -76.97 -52.66 9.0 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.898 0.879 . . . . 75.11 111.049 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -87.03 112.57 21.99 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.791 0.836 . . . . 72.3 111.45 -175.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.476 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 86.8 m-20 -69.63 128.11 35.32 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.998 -0.742 . . . . 64.42 108.998 168.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -75.53 118.75 18.73 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 -171.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 74.42 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.601 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 75.54 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.495 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.601 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 65.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.408 HG21 ' HZ1' ' B' ' 93' ' ' LYS . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 72.24 110.364 174.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.52 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.671 HG23 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.488 HG13 HD23 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 71.14 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.558 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 74.43 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 74.43 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.479 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 75.24 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 73.11 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 75.42 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.551 ' HG3' HD21 ' B' ' 118' ' ' LEU . 16.8 mm100 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 62.15 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.545 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 63.12 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.479 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 74.31 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 73.13 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 64.35 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.648 ' HA ' HE21 ' B' ' 47' ' ' GLN . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 62.11 111.768 -173.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.465 ' HB3' HD23 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . 0.648 HE21 ' HA ' ' B' ' 44' ' ' ASP . 4.5 pp0? -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . 0.434 HG23 HG22 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 74.22 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t -68.28 -34.37 76.05 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 74.1 112.761 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -52.32 123.07 27.23 Favored Pre-proline 0 CA--C 1.562 1.406 0 N-CA-C 114.023 1.12 . . . . 71.51 114.023 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -67.94 -75.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.564 2.007 0 C-N-CA 121.914 1.743 . . . . 74.43 109.719 156.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -94.61 179.51 5.24 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.807 -0.812 . . . . 64.4 108.807 161.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.437 HD11 ' NH1' ' B' ' 57' ' ' ARG . 34.0 mt -93.35 72.28 4.48 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.163 -0.961 . . . . 71.35 112.12 -165.714 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 39.7 t -98.68 -44.24 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.472 0.709 . . . . 75.11 111.288 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt -107.42 27.23 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 124.628 1.171 . . . . 65.13 111.94 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.437 ' NH1' HD11 ' B' ' 54' ' ' LEU . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 74.3 113.376 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 75.42 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 72.2 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.604 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.671 ' HB ' HG23 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 74.41 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . 0.434 HG22 HG23 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 74.34 111.048 172.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 65.33 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 74.35 111.58 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 74.34 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 64.11 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . 0.476 ' H ' ' HB3' ' B' ' 6' ' ' ASN . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.523 ' HG3' ' HE3' ' B' ' 105' ' ' MET . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 72.44 111.559 -179.237 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.447 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 74.32 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . 0.458 HG21 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 74.43 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 74.31 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.511 ' HB2' HG13 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 62.35 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.52 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 74.12 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.585 ' HA ' ' HE3' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 72.51 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 74.34 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.455 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.43 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 72.44 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.488 HD23 HG13 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 74.12 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG23 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . 0.567 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 73.45 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.408 ' HZ1' HG21 ' B' ' 20' ' ' THR . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 70.51 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.589 HG22 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 73.22 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.589 HG23 HG22 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 44.24 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 74.22 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.567 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 73.4 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 71.34 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . 0.426 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 55.23 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 74.45 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.511 HG13 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 73.44 114.626 -169.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.523 ' HE3' ' HG3' ' B' ' 74' ' ' LYS . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 73.01 110.789 172.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 73.43 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.545 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 52.03 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 73.35 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 75.15 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 74.23 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.551 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 71.45 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.719 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.609 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 74.31 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.544 HG23 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.609 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 75.12 110.389 -179.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.598 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 61.43 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 71.44 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 74.21 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.454 HG22 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.468 ' HA ' HG21 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 75.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.437 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 73.43 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.517 HD11 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 72.0 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.468 HG21 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 71.4 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.594 ' HB2' HD13 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.633 HD13 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 73.12 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -92.12 -52.9 4.48 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 75.24 110.379 178.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -168.26 -49.32 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 113.625 -1.625 . . . . 74.53 108.192 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 CA--C 1.573 1.846 0 C-N-CA 125.671 1.588 . . . . 72.2 114.416 169.13 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.111 0 CA-C-O 119.909 -0.384 . . . . 74.14 112.965 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 t -105.63 113.85 27.66 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.348 0.659 . . . . 73.52 110.015 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -138.08 -160.7 1.09 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.44 1.096 . . . . 72.41 110.93 -175.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -62.46 -41.68 98.93 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.481 0.712 . . . . 72.45 111.175 177.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -69.06 110.51 4.53 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.619 0.768 . . . . 63.21 111.065 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -73.56 84.89 1.56 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.762 -0.829 . . . . 74.03 108.762 170.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -83.39 125.72 31.97 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-O 121.402 0.62 . . . . 73.33 111.276 -172.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.93 -11.28 59.6 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 116.133 -0.485 . . . . 74.54 111.226 168.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 71.23 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.627 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 71.31 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 75.32 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 73.3 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.627 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 73.41 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 63.2 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 74.11 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.434 HD22 HD11 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 65.31 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.59 HG11 HD22 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 74.43 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 74.32 110.917 -173.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.483 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.598 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 71.44 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 73.21 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.46 HD13 HD23 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 75.23 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 72.34 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.505 ' HG3' HD23 ' A' ' 118' ' ' LEU . 17.0 mm100 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 73.5 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.595 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 74.05 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.505 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.13 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 73.44 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 71.22 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.508 ' HB3' HD11 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 75.24 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.505 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 75.12 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t -60.82 -34.1 74.03 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 74.33 112.094 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.569 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 12.0 t70 -94.4 136.18 23.57 Favored Pre-proline 0 CA--C 1.561 1.385 0 C-N-CA 124.019 0.927 . . . . 73.24 109.665 171.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -85.79 -44.64 0.05 OUTLIER 'Trans proline' 0 CA--C 1.571 2.349 0 C-N-CA 122.707 2.271 . . . . 74.43 114.837 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -61.22 147.19 45.15 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.531 1.308 . . . . 71.45 114.531 -166.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.612 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 2.5 pt? -75.86 -7.67 55.06 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.663 -1.153 . . . . 73.24 112.834 175.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.8 -42.17 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 123.331 0.653 . . . . 70.14 111.293 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.416 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt -114.21 23.72 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.107 0.563 . . . . 74.04 112.019 175.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB2' ' HA ' ' A' ' 54' ' ' LEU . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 74.15 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.569 ' HD3' ' HB3' ' A' ' 51' ' ' ASP . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 73.02 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.598 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 75.31 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 74.01 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 75.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.508 HD11 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 75.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.46 HD23 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.55 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.46 ' NH2' HG22 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 75.13 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 73.13 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.549 ' HD2' ' HE2' ' A' ' 105' ' ' MET . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . 0.403 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 74.4 111.009 170.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 63.43 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.527 ' HB2' HG12 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.413 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.55 111.621 176.027 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.5 110.494 -177.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.449 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.432 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 73.33 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.59 HD22 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 75.11 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.516 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.45 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.668 HG21 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.21 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.668 HG23 HG21 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 74.24 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 70.44 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.527 HG12 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 75.33 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.456 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.549 ' HE2' ' HD2' ' A' ' 74' ' ' LYS . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 74.42 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.402 ' O ' HD12 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 73.42 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . 0.595 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 73.04 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 71.02 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.25 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.505 HD23 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 74.41 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' MET . . . . . 0.472 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 73.21 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.472 HG22 ' O ' ' A' ' 120' ' ' MET . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 71.34 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 75.22 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 64.04 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.515 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 72.12 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.688 ' HA ' HG21 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.5 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 74.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.688 HG21 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 64.41 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.504 ' HB2' HD12 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 73.53 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.608 HD13 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 74.31 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm -100.82 -45.11 5.56 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 58.75 92.48 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.882 1.273 . . . . 74.23 111.238 -174.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 CA--C 1.567 1.602 0 C-N-CA 125.163 1.385 . . . . 73.44 111.943 -171.711 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.082 0 CA-C-O 120.803 0.113 . . . . 64.41 113.017 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -83.68 28.29 0.58 Allowed 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 123.752 0.821 . . . . 74.14 112.91 -175.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -59.55 134.66 57.22 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.192 0.997 . . . . 75.31 112.494 -177.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -86.42 -51.18 6.37 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 122.908 0.483 . . . . 75.11 110.172 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.71 123.14 17.63 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.009 0.924 . . . . 72.3 111.678 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . 0.588 ' HB3' ' HA3' ' B' ' 72' ' ' GLY . 11.2 m120 -59.0 98.22 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 125.158 1.383 . . . . 64.42 112.517 -176.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -100.09 113.96 26.96 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 -175.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 74.42 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 75.54 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . 0.414 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 65.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 72.24 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.486 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.681 HG11 HD22 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 71.14 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.437 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 74.43 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 74.43 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.482 HG23 HD13 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 75.24 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.462 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.481 HD11 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 73.11 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 75.42 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . 0.593 ' HG3' HD21 ' B' ' 118' ' ' LEU . 15.2 mm100 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 62.15 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HG2' ' HB3' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 63.12 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.482 HD13 HG23 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 74.31 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 73.13 110.157 176.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 64.35 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 62.11 112.079 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 30.4 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 74.22 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -58.95 -34.75 72.13 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 74.1 110.738 166.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.521 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 2.4 m-20 -120.68 90.24 45.9 Favored Pre-proline 0 CA--C 1.559 1.316 0 N-CA-C 107.236 -1.394 . . . . 71.51 107.236 168.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -87.94 -11.45 4.62 Favored 'Trans proline' 0 CA--C 1.556 1.613 0 C-N-CA 123.02 2.48 . . . . 74.43 114.994 -170.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -62.0 157.29 19.06 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 113.662 0.986 . . . . 64.4 113.662 -168.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.713 ' HA ' ' HD2' ' B' ' 57' ' ' ARG . 2.1 pt? -59.88 -21.63 61.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 114.558 -1.201 . . . . 71.35 113.65 -177.093 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -64.5 -48.9 83.09 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.823 0.849 . . . . 75.11 111.17 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . 0.421 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp -122.82 7.17 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 65.13 113.954 -173.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.713 ' HD2' ' HA ' ' B' ' 54' ' ' LEU . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 74.3 111.689 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 75.42 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 72.2 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.521 ' HE3' ' HB2' ' B' ' 51' ' ' ASP . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.486 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 74.41 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 74.34 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 65.33 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . 0.561 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 74.35 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.481 HD21 HD11 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 74.34 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . 0.588 ' HA3' ' HB3' ' B' ' 6' ' ' ASN . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 64.11 114.75 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 72.44 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 74.32 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 74.43 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 74.31 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.53 ' HB2' HG12 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . 0.462 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 62.35 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 74.12 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.409 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 72.51 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 74.34 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.43 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . 0.409 ' HG3' HD21 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 72.44 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.681 HD22 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 74.12 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . 0.526 ' HH ' HG21 ' B' ' 102' ' ' VAL . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 73.45 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.515 ' HD3' HD11 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 70.51 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . 0.437 HG21 HG22 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 73.22 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.437 HG22 HG21 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 44.24 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 74.22 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . 0.583 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 73.4 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 71.34 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 55.23 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 74.45 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . 0.53 HG12 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.495 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 73.44 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.495 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 73.01 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 73.43 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.475 ' HB3' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 52.03 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 73.35 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 75.15 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 74.23 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . 0.593 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 71.45 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.595 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.44 ' O ' HG21 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.529 ' HA ' ' HE2' ' B' ' 124' ' ' MET . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 74.31 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.529 ' HE2' ' HA ' ' B' ' 121' ' ' THR . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 75.12 110.445 -178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.441 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 61.43 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 71.44 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.473 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 74.21 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . 0.436 HG21 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.479 ' HA ' HG21 ' B' ' 134' ' ' THR . 8.3 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 75.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 73.43 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 72.0 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.479 HG21 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 71.4 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.608 ' HB2' HD13 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.504 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 73.12 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.428 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm -97.71 -47.45 5.6 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 75.24 112.815 -171.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 30.2 t70 59.17 37.31 24.01 Favored 'General case' 0 CA--C 1.566 1.582 0 O-C-N 124.466 1.104 . . . . 74.53 111.085 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 CA--C 1.566 1.559 0 C-N-CA 124.99 1.316 . . . . 72.2 112.351 -175.756 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 CA-C-O 120.089 -0.284 . . . . 74.14 112.525 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.5 m -86.07 55.96 3.77 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.4 0.68 . . . . 73.52 110.828 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -152.46 173.24 15.37 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.713 0.805 . . . . 72.41 110.822 -176.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.33 -3.19 40.93 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.716 0.807 . . . . 72.45 112.346 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.86 18.46 13.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.597 0.759 . . . . 63.21 111.85 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -57.74 110.29 0.87 Allowed 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.858 0.863 . . . . 74.03 111.259 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.01 96.86 0.1 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.509 0.929 . . . . 73.33 113.509 -177.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -80.62 -21.45 41.5 Favored 'General case' 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 151.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 71.23 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.414 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.445 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 71.31 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 75.32 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 73.3 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.445 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 73.41 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.458 ' HG2' HD13 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 63.2 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 74.11 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.591 HD22 HD11 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 65.31 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.466 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.479 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 74.43 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 74.32 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.74 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 71.44 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 73.21 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 75.23 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 72.34 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 73.5 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 74.05 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.772 HD23 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.13 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 73.44 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 71.22 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.672 ' HB3' HD11 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 75.24 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.772 ' HB3' HD23 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 75.12 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.414 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t -58.11 -31.73 67.43 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 74.33 110.734 169.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HB3' ' ND2' ' A' ' 53' ' ' ASN . 17.7 m-20 -114.74 91.05 24.14 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 123.731 0.812 . . . . 73.24 110.106 169.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -59.8 -17.0 40.88 Favored 'Trans proline' 0 C--N 1.378 2.108 0 C-N-CA 122.857 2.371 . . . . 74.43 114.511 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . 0.444 ' ND2' ' HB3' ' A' ' 51' ' ' ASP . 10.2 p30 -62.74 155.16 27.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 113.369 0.877 . . . . 71.45 113.369 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.594 ' HB2' HH11 ' A' ' 57' ' ' ARG . 2.1 pt? -95.37 22.88 6.4 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.503 0.721 . . . . 73.24 112.05 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.3 t -81.28 -56.34 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 122.093 -0.379 . . . . 70.14 111.251 -179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt -92.62 24.82 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 74.04 114.082 -171.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.615 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.466 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 74.15 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.615 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 73.02 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.74 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 75.31 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 74.01 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.526 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 75.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.672 HD11 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 75.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.55 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 75.13 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 73.13 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.543 ' HD2' ' HE1' ' A' ' 105' ' ' MET . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 74.4 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.407 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 63.43 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.455 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.55 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.5 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.421 ' HG ' ' HE3' ' B' ' 120' ' ' MET . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . 0.517 ' HB3' HD22 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 73.33 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' PRO . . . . . 0.72 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.591 HD11 HD22 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TYR . . . . . 0.516 ' HA ' HG21 ' A' ' 94' ' ' VAL . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 75.11 112.224 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.432 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.45 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.516 HG21 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.21 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.499 HG21 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 74.24 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.412 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . 0.484 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 70.44 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.72 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 75.33 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . 0.416 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . 0.44 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' MET . . . . . 0.543 ' HE1' ' HD2' ' A' ' 74' ' ' LYS . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 74.42 111.412 170.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.46 HD13 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 73.42 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.472 HG22 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 73.04 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . 0.472 ' HG3' HG22 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 71.02 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.46 ' HB2' HD13 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.25 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.643 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 74.41 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 73.21 112.895 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' THR . . . . . 0.642 ' HA ' ' HE2' ' A' ' 124' ' ' MET . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' VAL . . . . . 0.487 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' MET . . . . . 0.642 ' HE2' ' HA ' ' A' ' 121' ' ' THR . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 71.34 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.417 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 75.22 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 64.04 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LYS . . . . . 0.428 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 72.12 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLN . . . . . 0.523 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.5 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 74.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.432 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' THR . . . . . 0.523 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 64.41 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.532 ' HB2' HD12 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 73.53 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' LEU . . . . . 0.505 HD12 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 74.31 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.497 ' HZ1' ' HB3' ' A' ' 140' ' ' LYS . 9.2 mtpm? -84.88 169.14 14.41 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -100.82 44.82 1.0 Allowed 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 114.947 -1.024 . . . . 74.23 109.644 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.566 1.594 0 C-N-CA 125.487 1.515 . . . . 73.44 111.605 -177.438 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 119.851 -0.416 . . . . 64.41 113.159 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 72.52 4.45 5.0 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.199 1.399 . . . . 74.14 113.516 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -102.43 -161.51 0.85 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.807 0.843 . . . . 75.31 111.085 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -77.74 -47.72 18.37 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.122 0.569 . . . . 75.11 111.984 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -111.01 88.68 2.84 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.314 0.578 . . . . 72.3 110.635 -174.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -94.36 96.8 9.77 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.128 0.571 . . . . 64.42 109.676 -178.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -79.42 77.29 5.98 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 -173.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 74.42 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 75.54 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.404 ' O ' HG21 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 65.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 72.24 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' LEU . . . . . 0.716 HD22 HD11 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.54 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' VAL . . . . . 0.507 HG12 HD22 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 71.14 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ASP . . . . . 0.452 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 74.43 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.839 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 74.43 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ILE . . . . . 0.636 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' THR . . . . . 0.442 ' HA ' HD11 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 75.24 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' TYR . . . . . 0.422 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.51 HD12 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 73.11 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 75.42 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' CYS . . . . . 0.4 ' HG ' ' HG2' ' B' ' 81' ' ' GLU . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 62.15 111.226 170.144 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' LYS . . . . . 0.424 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 63.12 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' LEU . . . . . 0.557 HD23 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 74.31 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 73.13 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 64.35 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 62.11 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.557 ' HB3' HD23 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 74.22 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t -60.41 -33.22 72.19 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 74.1 110.308 167.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' ASP . . . . . 0.441 ' HB3' HD22 ' B' ' 53' ' ' ASN . 11.4 m-20 -121.35 93.14 48.8 Favored Pre-proline 0 CA--C 1.561 1.391 0 C-N-CA 124.189 0.995 . . . . 71.51 109.13 169.654 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.77 -10.57 28.69 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 123.255 2.636 . . . . 74.43 114.849 -178.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . 0.441 HD22 ' HB3' ' B' ' 51' ' ' ASP . 9.2 p30 -68.83 153.84 43.06 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.677 0.791 . . . . 64.4 112.488 -177.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' LEU . . . . . 0.549 HD21 ' H ' ' B' ' 54' ' ' LEU . 2.0 pt? -87.5 5.59 38.35 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.105 0.562 . . . . 71.35 111.631 178.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -73.81 -35.9 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 C-N-CA 123.333 0.653 . . . . 75.11 110.93 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp -104.61 21.72 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 123.8 0.84 . . . . 65.13 111.979 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.452 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 74.3 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' LYS . . . . . 0.525 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 75.42 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 72.2 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' B' ' 51' ' ' ASP . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.839 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 74.41 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 74.34 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . 0.403 HD11 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 65.33 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 74.35 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . 0.51 HD11 HD12 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 74.34 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' ARG . . . . . 0.544 ' HG3' HG21 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.544 HG21 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 64.11 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' LYS . . . . . 0.501 ' HD2' ' HE3' ' B' ' 105' ' ' MET . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 72.44 111.297 171.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 74.32 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 74.43 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 74.31 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . 0.427 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' GLU . . . . . 0.422 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 62.35 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 74.12 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.622 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 72.51 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 74.34 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.43 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 72.44 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' LEU . . . . . 0.716 HD11 HD22 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 74.12 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 73.45 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' LYS . . . . . 0.611 ' HZ1' ' HB3' ' B' ' 93' ' ' LYS . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 70.51 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 73.22 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' THR . . . . . 0.47 ' HB ' ' HZ2' ' B' ' 97' ' ' LYS . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 44.24 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.47 ' HZ2' ' HB ' ' B' ' 95' ' ' THR . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 74.22 111.997 178.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 73.4 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 71.34 112.654 172.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 55.23 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 74.45 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 103' ' ' PHE . . . . . 0.489 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 73.44 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 105' ' ' MET . . . . . 0.501 ' HE3' ' HD2' ' B' ' 74' ' ' LYS . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ILE . . . . . 0.519 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ILE . . . . . 0.489 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 73.01 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 73.43 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' ALA . . . . . 0.424 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 52.03 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 73.35 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 115' ' ' LEU . . . . . 0.519 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 75.15 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 74.23 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 71.45 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 119' ' ' LEU . . . . . 0.643 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 120' ' ' MET . . . . . 0.421 ' HE3' ' HG ' ' A' ' 85' ' ' LEU . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 121' ' ' THR . . . . . 0.494 ' HA ' ' HE3' ' B' ' 124' ' ' MET . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.622 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 74.31 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 123' ' ' VAL . . . . . 0.472 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 124' ' ' MET . . . . . 0.494 ' HE3' ' HA ' ' B' ' 121' ' ' THR . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 75.12 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 125' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 126' ' ' LEU . . . . . 0.417 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 61.43 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 127' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 71.44 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 128' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 129' ' ' LYS . . . . . 0.511 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 74.21 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 131' ' ' GLN . . . . . 0.577 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 75.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 73.43 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 133' ' ' LEU . . . . . 0.511 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 72.0 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 134' ' ' THR . . . . . 0.577 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 71.4 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 136' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 137' ' ' LEU . . . . . 0.532 HD12 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 73.12 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 140' ' ' LYS . . . . . 0.423 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt -77.58 165.81 23.83 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 75.24 113.775 -175.229 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -113.31 -36.23 5.07 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 113.476 -1.693 . . . . 74.53 109.125 171.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.42 0 C-N-CA 124.024 0.93 . . . . 72.2 110.654 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 120.338 0.114 . . . . 74.54 111.082 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 64.43 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.591 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 63.21 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 74.31 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 72.25 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 72.43 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 61.45 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 51.5 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 63.34 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.643 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.556 HG11 HD21 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 73.13 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 73.41 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 HD11 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 51.3 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 71.14 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 74.13 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 64.22 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 72.24 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 73.31 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.12 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 72.34 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 54.23 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 74.43 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 70.5 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 53.0 110.744 173.434 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.475 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt . . . . . 0 CA--C 1.56 1.329 0 N-CA-C 111.676 0.25 . . . . 71.23 111.676 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 65.41 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.475 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.595 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 55.22 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.643 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 52.03 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 34.04 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 74.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 74.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.423 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.43 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 71.25 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 34.32 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.591 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 63.03 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 52.11 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.407 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.11 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.23 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.503 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 71.13 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.56 ' HG3' HD22 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.56 HD22 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 71.32 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.32 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.02 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 42.33 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.455 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 62.32 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 74.43 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.499 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.407 ' HB3' ' OE1' ' A' ' 81' ' ' GLU . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 63.44 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 63.32 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 33.21 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 62.22 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.11 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 61.44 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.636 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 72.11 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.503 ' HG2' HD21 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 64.33 110.985 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 73.23 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 44.41 110.367 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 62.11 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.41 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 54.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 42.54 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.42 ' HB2' HD11 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 63.34 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 45.45 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.439 ' HD2' HD23 ' B' ' 137' ' ' LEU . 10.0 mtpm? . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 109.658 -0.497 . . . . 63.54 109.658 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.528 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 73.23 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 65.25 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 61.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.445 HG21 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 50.45 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.552 HD23 HD12 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.47 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.76 HG11 HD21 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 51.11 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.471 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 71.51 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.688 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 60.45 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.471 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.688 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 74.42 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.474 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 71.5 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 61.54 110.97 169.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.58 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 60.21 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.605 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 61.23 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.476 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 71.24 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 70.21 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 51.55 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.428 ' HB3' HG21 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 54.02 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.476 ' HB3' HD21 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 70.42 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 73.21 109.851 168.558 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.426 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt . . . . . 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 64.42 112.798 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 63.2 114.231 -178.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 72.25 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 50.24 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.577 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 64.31 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 71.32 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.528 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 54.2 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.428 HG21 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 64.02 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 60.31 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 31.24 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 60.23 112.147 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 73.04 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.58 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 54.22 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 73.2 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 61.32 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 62.3 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 71.22 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 73.25 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.512 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.21 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.455 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 71.13 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.76 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 52.22 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 72.55 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' B' ' 20' ' ' THR . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 65.4 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 54.4 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.504 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 15.41 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.504 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 73.23 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 72.23 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 64.31 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 42.12 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.636 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 72.11 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.465 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 71.32 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.426 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.466 HD12 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 65.34 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 64.34 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.466 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 51.55 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 54.41 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 74.52 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 72.04 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 60.3 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.488 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 73.43 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.516 HG13 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 65.32 109.815 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 53.42 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 62.14 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.448 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 42.42 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.606 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 70.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 72.22 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.448 HD21 ' HE3' ' B' ' 129' ' ' LYS . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.606 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 62.33 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.48 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 133' ' ' LEU . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 72.41 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 71.24 112.116 -177.891 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 112.127 0.417 . . . . 74.54 112.127 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 64.43 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 63.21 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 74.31 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 72.25 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 72.43 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 61.45 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 51.5 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 63.34 111.509 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.615 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.427 ' HB ' HD12 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 73.13 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 73.41 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.522 ' O ' HG23 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 51.3 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 71.14 112.401 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 HD21 ' A' ' 68' ' ' LEU . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 74.13 111.748 174.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 64.22 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.431 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 72.24 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 73.31 112.625 174.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.12 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 72.34 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 54.23 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 74.43 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 70.5 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 53.0 113.398 -177.83 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp . . . . . 0 CA--C 1.557 1.226 0 N-CA-C 112.015 0.376 . . . . 71.23 112.015 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 65.41 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 55.22 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.467 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 52.03 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 34.04 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 74.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 74.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.43 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 71.25 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 34.32 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 63.03 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 73' ' ' HIS . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 52.11 111.786 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.11 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.23 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HG ' HG21 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 71.13 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.608 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.499 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 71.32 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.32 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.02 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 42.33 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 62.32 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 74.43 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.439 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 63.44 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.549 HG23 HD22 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 63.32 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.426 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 33.21 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.444 ' HA ' HD12 ' A' ' 107' ' ' ILE . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 62.22 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.549 HD22 HG23 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.11 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 61.44 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.483 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 72.11 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 64.33 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 73.23 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 44.41 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.453 HG13 HD11 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 62.11 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.41 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 54.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.532 HD13 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.549 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 42.54 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 63.34 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.649 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 45.45 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 . . . . . 0 CA--C 1.563 1.456 0 CA-C-O 122.023 0.916 . . . . 63.54 110.969 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.404 ' SG ' ' CE1' ' B' ' 73' ' ' HIS . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 73.23 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.613 ' HB3' HD11 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 65.25 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 61.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 50.45 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.613 HD11 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.724 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 51.11 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.479 HD11 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 71.51 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.561 ' HD3' HG22 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 60.45 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 74.42 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 71.5 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 61.54 110.779 171.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.4 ' OE1' HD13 ' B' ' 118' ' ' LEU . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 60.21 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.597 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 61.23 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 71.24 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 70.21 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 51.55 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 54.02 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.425 ' HA ' ' HB2' ' B' ' 50' ' ' SER . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.504 HG21 HD13 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 70.42 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 73.21 112.062 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.554 1.112 0 CA-C-O 120.654 0.264 . . . . 64.42 111.657 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.607 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 63.2 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 72.25 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 50.24 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.561 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 64.31 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.504 HD13 HG21 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 71.32 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 54.2 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 64.02 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 60.31 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 31.24 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 60.23 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.459 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 73.04 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.481 HG23 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 54.22 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 73.2 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 61.32 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 62.3 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 71.22 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 73.25 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.663 ' HB3' HD23 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.21 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 71.13 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.724 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 52.22 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.447 ' HA ' HG22 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 72.55 112.905 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 65.4 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.583 HG23 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 54.4 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.583 HG23 HG23 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 15.41 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 73.23 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 72.23 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 64.31 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 100' ' ' ALA . . . . . 0.491 ' HB3' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 42.12 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 72.11 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.491 HG23 ' HB3' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.407 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 71.32 114.415 173.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.628 HD12 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 65.34 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 64.34 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.63 ' HA ' HD12 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 51.55 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 54.41 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.628 HD13 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 74.52 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 72.04 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 60.3 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.536 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 73.43 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 65.32 110.419 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 53.42 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 62.14 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 42.42 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 70.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 72.22 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 71.32 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 62.33 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 72.41 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? . . . . . 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 71.24 110.274 169.625 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.49 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 64.43 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.454 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 63.21 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 74.31 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 72.25 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 72.43 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 61.45 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 51.5 111.13 176.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.462 HD23 HD12 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 63.34 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.633 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG11 HD21 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 73.13 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.426 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 73.41 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.704 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 51.3 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.447 ' HB2' HD22 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 71.14 110.275 177.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 74.13 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 64.22 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 73.31 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.12 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 72.34 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 54.23 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 74.43 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 70.5 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 53.0 110.59 168.268 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 CA--C 1.55 0.955 0 N-CA-C 112.3 0.481 . . . . 71.23 112.3 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 65.41 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.704 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 55.22 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.633 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 52.03 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 34.04 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 74.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.544 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 74.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.476 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.43 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.544 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 71.25 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 34.32 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 63.03 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 52.11 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.476 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.11 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.23 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.406 ' HG2' ' HB3' ' A' ' 99' ' ' PRO . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 71.13 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 71.32 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.517 ' HD3' HD13 ' A' ' 90' ' ' LEU . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.32 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.02 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 42.33 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.406 ' HB3' ' HG2' ' A' ' 84' ' ' GLU . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 62.32 115.235 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 74.43 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.421 ' O ' HG12 ' A' ' 107' ' ' ILE . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.481 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 63.44 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 63.32 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 33.21 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 107' ' ' ILE . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 62.22 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD12 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.11 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 61.44 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 72.11 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.455 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 64.33 109.935 176.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 73.23 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 44.41 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 62.11 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.647 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.41 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 54.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.47 HD11 HG13 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.647 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 42.54 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.607 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 63.34 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 45.45 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.417 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.447 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 73.23 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' VAL . . . . . 0.44 HG11 HG22 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 65.25 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.723 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 61.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 50.45 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.521 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.555 HG11 HD21 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 51.11 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 71.51 109.405 172.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.491 ' HB3' HD11 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 60.45 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 74.42 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.472 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 71.5 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 61.54 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 60.21 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 61.23 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 71.24 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 70.21 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 51.55 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.484 ' O ' HG22 ' B' ' 48' ' ' VAL . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 54.02 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.586 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.484 HG22 ' O ' ' B' ' 44' ' ' ASP . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 70.42 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 73.21 111.587 172.975 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.428 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 112.529 0.566 . . . . 64.42 112.529 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.537 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 63.2 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 72.25 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.428 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 50.24 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 64.31 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.439 HG23 HG12 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HB2' HG11 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 71.32 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.447 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 54.2 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' B' ' 64' ' ' LEU . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 64.02 110.762 174.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.472 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 60.31 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 31.24 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 60.23 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.56 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 73.04 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 54.22 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 73.2 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 61.32 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 62.3 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 71.22 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 73.25 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.697 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.21 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.495 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 71.13 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.697 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 52.22 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.465 ' CZ ' HG21 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 72.55 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 65.4 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.723 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 54.4 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.642 HG23 HG23 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 15.41 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 73.23 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 72.23 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.689 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 64.31 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 42.12 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.689 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 72.11 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.427 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 71.32 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.638 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.505 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.638 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 65.34 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 64.34 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 51.55 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.442 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 54.41 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 74.52 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 72.04 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 60.3 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.512 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 73.43 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.512 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 65.32 110.187 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 53.42 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 62.14 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 42.42 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 70.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.508 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 72.22 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.513 HD13 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 71.32 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.533 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 62.33 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 72.41 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 71.24 111.944 -173.762 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 CA--C 1.562 1.42 0 N-CA-C 112.379 0.511 . . . . 74.54 112.379 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 64.43 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 63.21 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 74.31 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 72.25 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 72.43 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 61.45 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 51.5 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 63.34 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.721 HG11 HD21 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 73.13 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.564 HD13 HD11 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 73.41 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.645 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.548 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 51.3 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 71.14 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 74.13 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.424 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 64.22 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 72.24 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 73.31 112.288 173.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.783 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.12 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 72.34 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.424 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 54.23 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.623 ' HB2' HD13 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 74.43 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.783 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 70.5 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 53.0 110.398 170.049 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 65.41 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.645 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 55.22 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 52.03 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 34.04 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.607 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 74.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.623 HD13 ' HB2' ' A' ' 44' ' ' ASP . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 74.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.43 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 71.25 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 34.32 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.481 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 63.03 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.432 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 52.11 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.454 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.543 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.11 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.23 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.69 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 71.13 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.721 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.543 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 71.32 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HB3' ' HE2' ' A' ' 93' ' ' LYS . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.32 112.337 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.02 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 42.33 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.486 ' H ' ' HD2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 62.32 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 74.43 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.571 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.481 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 63.44 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 63.32 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 33.21 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 62.22 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.571 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.11 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.481 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 61.44 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.69 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 72.11 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 64.33 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 73.23 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 44.41 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 62.11 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.73 ' HA ' HG22 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.41 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 54.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.73 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 42.54 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.494 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 63.34 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 45.45 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' HD23 ' B' ' 137' ' ' LEU . 43.3 mtpt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 29.4 t70 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.432 0.634 . . . . 63.54 111.221 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 73.23 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.428 HD23 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 65.25 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 61.41 111.998 -173.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 50.45 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.575 ' HA ' HD13 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.549 HG22 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.638 HG11 HD21 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 51.11 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.575 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 71.51 109.713 175.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 60.45 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 74.42 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 71.5 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 61.54 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' B' ' 118' ' ' LEU . 27.7 mm-40 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 60.21 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 61.23 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 71.24 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 70.21 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 51.55 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.624 ' HB3' HD13 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 54.02 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.543 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD11 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 70.42 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 73.21 111.412 177.685 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.984 0.421 . . . . 64.42 111.856 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 63.2 114.086 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 72.25 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 50.24 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 64.31 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 71.32 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 54.2 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' ASP . . . . . 0.405 ' HA ' ' HG3' ' B' ' 69' ' ' GLN . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 64.02 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 60.31 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' B' ' 66' ' ' ASP . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 31.24 113.468 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' HIS . . . . . 0.463 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 60.23 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 73.04 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 54.22 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 73.2 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.589 ' HB2' HD13 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 61.32 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' B' ' 87' ' ' TYR . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 62.3 111.554 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 71.22 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 73.25 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.528 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.21 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.639 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 71.13 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.639 HD22 ' HG3' ' B' ' 89' ' ' GLN . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 52.22 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 72.55 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 65.4 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.431 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 54.4 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 15.41 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 73.23 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.701 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 72.23 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 64.31 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 42.12 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.69 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 72.11 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' B' ' 115' ' ' LEU . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 71.32 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.541 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.493 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 65.34 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 64.34 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.483 ' HA ' HD12 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 51.55 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 54.41 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.541 HD13 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 74.52 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 72.04 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 60.3 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.545 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 73.43 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.4 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 65.32 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 53.42 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 62.14 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' B' ' 124' ' ' MET . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 42.42 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 70.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 72.22 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.665 HD13 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 71.32 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 62.33 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.523 ' HB2' HD11 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.494 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 72.41 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? . . . . . 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 71.24 111.583 172.375 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 112.803 0.668 . . . . 74.54 112.803 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 64.43 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.481 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 63.21 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 74.31 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 72.25 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 72.43 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 61.45 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 51.5 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.487 HD23 HD12 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 63.34 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.681 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.52 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.57 HG11 HD21 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 73.13 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD11 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 73.41 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 27' ' ' PRO . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 51.3 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 71.14 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD13 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 74.13 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.443 ' HG2' HD22 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 64.22 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.472 ' OE1' HD13 ' A' ' 118' ' ' LEU . 53.2 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 72.24 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.431 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 73.31 114.036 173.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.12 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 72.34 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 54.23 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 74.43 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.407 ' H ' HD21 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 70.5 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 53.0 111.108 170.615 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt . . . . . 0 CA--C 1.564 1.5 0 N-CA-C 112.149 0.426 . . . . 71.23 112.149 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 61' ' ' VAL . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 65.41 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 55.22 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.681 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 52.03 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 34.04 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.545 HD22 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 74.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 74.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.43 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 71.25 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 34.32 110.983 172.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 63.03 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 52.11 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.11 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.23 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 71.13 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 71.32 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.32 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.02 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 42.33 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 62.32 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 74.43 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 63.44 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.743 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 63.32 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 33.21 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.419 ' HA ' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 62.22 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.743 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.44 HG21 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.447 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.11 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 115' ' ' LEU . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 61.44 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 72.11 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.507 HG13 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.486 ' O ' ' HD3' ' A' ' 128' ' ' LYS . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 64.33 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 73.23 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 44.41 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.526 HG13 HD11 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 62.11 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.482 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.41 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 54.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 42.54 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 63.34 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 45.45 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.478 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 73.23 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 65.25 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 61.41 112.011 177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 50.45 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.606 ' HA ' HD13 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.582 HG22 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.659 HG11 HD21 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 51.11 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.606 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 71.51 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.693 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.482 ' HB3' HD11 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 60.45 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.601 HG22 HD11 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 74.42 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 71.5 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 61.54 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD11 ' B' ' 118' ' ' LEU . 18.7 mm-40 -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 60.21 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.448 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 61.23 112.851 175.338 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.659 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 71.24 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 70.21 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 51.55 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 54.02 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.659 ' HB3' HD21 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.59 HG22 HG23 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 70.42 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 73.21 109.492 161.208 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.403 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 27.2 pt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 64.42 113.562 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 63.2 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.488 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 72.25 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 50.24 110.943 176.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.52 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.693 HG22 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 64.31 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.59 HG23 HG22 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.418 HD11 HD12 ' B' ' 40' ' ' LEU . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 71.32 111.009 173.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.478 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 54.2 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 64.02 110.693 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.462 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 60.31 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 31.24 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.563 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 60.23 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 73.04 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 54.22 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 73.2 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 61.32 109.868 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 62.3 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.543 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 71.22 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 73.25 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.562 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.21 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.407 ' HG3' HD22 ' B' ' 90' ' ' LEU . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 71.13 111.779 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.659 HD21 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 52.22 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.442 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 72.55 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 65.4 112.488 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 54.4 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 15.41 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' B' ' 92' ' ' LYS . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 73.23 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 72.23 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.415 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 64.31 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 42.12 111.305 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.447 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 72.11 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.543 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 71.32 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.44 HD11 HG21 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 65.34 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 64.34 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 51.55 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 54.41 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 74.52 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.488 HG21 HD11 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 72.04 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.555 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 60.3 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.4 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 73.43 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.452 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 65.32 109.48 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 53.42 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 62.14 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.482 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 42.42 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 70.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 72.22 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.526 HD11 HG13 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 71.32 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 62.33 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.557 ' HB2' HD11 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 72.41 108.331 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 71.24 111.784 178.502 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 112.102 0.408 . . . . 74.54 112.102 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 64.43 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 63.21 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 74.31 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 72.25 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 72.43 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' HB2' HG12 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 61.45 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 51.5 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.504 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 63.34 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 73.13 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.464 HD11 HD22 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 73.41 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 27' ' ' PRO . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 51.3 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 71.14 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 74.13 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 64.22 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 72.24 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 73.31 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.12 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 72.34 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 54.23 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.62 ' HB2' HD13 ' A' ' 67' ' ' ILE . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 74.43 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.758 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 70.5 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.608 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.462 HG22 HG23 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 53.0 109.12 166.904 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 120.237 0.065 . . . . 71.23 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.655 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 65.41 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 55.22 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.486 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 52.03 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 34.04 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.462 HG23 HG22 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 74.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.62 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 74.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.43 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 71.25 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 34.32 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 63.03 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' HD12 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 52.11 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.466 ' HB2' HD13 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.11 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.23 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.404 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 71.13 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.504 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 71.32 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.32 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.475 HG12 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.02 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 42.33 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 62.32 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 74.43 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.532 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 63.44 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 63.32 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.536 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 33.21 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 62.22 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.11 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 61.44 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 72.11 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 64.33 110.88 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 53.7 tp60 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 73.23 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 44.41 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 62.11 111.667 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.466 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.41 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 54.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.466 HG22 ' HA ' ' A' ' 131' ' ' GLN . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 42.54 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 63.34 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.675 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 45.45 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm . . . . . 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 . . . . . 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 73.23 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 65.25 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 61.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 50.45 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.571 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.75 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 51.11 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 71.51 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.733 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 60.45 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 74.42 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 71.5 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.568 ' HD3' HD22 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 61.54 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 60.21 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 61.23 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 71.24 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 70.21 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 51.55 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 54.02 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.598 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 70.42 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 73.21 108.84 163.97 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 64.42 112.273 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 63.2 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.415 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 72.25 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 50.24 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.733 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 64.31 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 71.32 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 54.2 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 64.02 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 60.31 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 31.24 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.496 ' HB3' HG12 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 60.23 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 73.04 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 54.22 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 73.2 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 61.32 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 62.3 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.401 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 71.22 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 73.25 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.662 ' HB3' HD23 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.21 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 71.13 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.75 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 52.22 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.504 ' HA ' HG22 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 72.55 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 65.4 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.526 HG23 HG23 ' B' ' 95' ' ' THR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 54.4 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.526 HG23 HG23 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 15.41 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 73.23 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 72.23 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 64.31 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 42.12 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 72.11 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.541 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 71.32 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.474 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.541 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 65.34 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 64.34 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' B' ' 106' ' ' ILE . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 51.55 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 54.41 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.436 HD21 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 74.52 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 72.04 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 60.3 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.535 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 73.43 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 65.32 109.811 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 53.42 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 62.14 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.539 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 42.42 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.612 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.8 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 70.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 72.22 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 71.32 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.612 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 62.33 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 72.41 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 71.24 111.892 178.827 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 CA--C 1.557 1.221 0 N-CA-C 112.215 0.45 . . . . 74.54 112.215 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 64.43 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.401 ' HB3' ' CG ' ' A' ' 76' ' ' TYR . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 63.21 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 74.31 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 72.25 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 72.43 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.513 ' HD2' HD13 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 61.45 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 51.5 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.557 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 63.34 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.444 HG22 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 73.13 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 73.41 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 51.3 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 71.14 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 74.13 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 64.22 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 72.24 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 73.31 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD11 HG22 ' A' ' 31' ' ' THR . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.12 110.476 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 72.34 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 54.23 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 74.43 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 70.5 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 53.0 112.87 174.191 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 71.23 114.142 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 65.41 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 55.22 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 52.03 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 34.04 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 74.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 74.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.43 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 71.25 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 34.32 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 63.03 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 52.11 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.557 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.11 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.23 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.411 ' HB3' HD23 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 71.13 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.423 ' HG3' HD22 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 71.32 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.32 112.862 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 21' ' ' LEU . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.02 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 42.33 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 62.32 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 74.43 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 63.44 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 63.32 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 33.21 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 62.22 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.11 111.666 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 61.44 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 72.11 113.021 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 64.33 110.155 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 73.23 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 44.41 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.488 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 62.11 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.59 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.41 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.528 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 54.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.59 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 42.54 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 63.34 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 45.45 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? . . . . . 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.444 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 73.23 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 65.25 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 61.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 50.45 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.461 HG21 HD11 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 51.11 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 71.51 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.578 ' HD3' HG22 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 60.45 112.111 -170.035 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.582 HG22 HD11 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 74.42 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' PRO . . . . . 0.413 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.455 HD13 HD11 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 71.5 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 61.54 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 60.21 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.573 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 61.23 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.817 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 71.24 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 70.21 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 51.55 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.598 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 54.02 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.817 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.534 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 3.7 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.533 HG22 HG23 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 70.42 111.779 177.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 73.21 112.968 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.437 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt . . . . . 0 CA--C 1.559 1.325 0 N-CA-C 112.7 0.63 . . . . 64.42 112.7 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 63.2 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.504 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 72.25 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 50.24 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.578 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 64.31 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.533 HG23 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 71.32 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 54.2 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.598 HG21 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 64.02 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.455 HD11 HD13 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 60.31 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 31.24 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' HIS . . . . . 0.469 ' O ' HG23 ' B' ' 77' ' ' VAL . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 60.23 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.464 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 73.04 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.469 HG23 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 54.22 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 73.2 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 61.32 110.673 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.617 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 62.3 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.512 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 71.22 110.331 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 73.25 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.617 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.21 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 71.13 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 52.22 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 72.55 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 65.4 112.03 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 54.4 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 15.41 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 73.23 111.611 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 72.23 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 64.31 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 42.12 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.512 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 72.11 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.505 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 71.32 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.532 HD12 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 65.34 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 64.34 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.532 ' HG3' HD12 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 51.55 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 54.41 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 74.52 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.441 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 72.04 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 60.3 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.457 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' THR . . . . . 0.441 HG22 ' O ' ' B' ' 117' ' ' GLN . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 73.43 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.457 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 65.32 110.151 176.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 53.42 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 62.14 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.532 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 42.42 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.629 ' HA ' HG22 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 70.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 72.22 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.566 HD13 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 71.32 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.629 HG22 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 62.33 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 72.41 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 47.8 tttm . . . . . 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 71.24 110.32 178.523 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 111.675 0.25 . . . . 74.54 111.675 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 64.43 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 63.21 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 74.31 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 72.25 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 72.43 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 61.45 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 51.5 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 63.34 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 73.13 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.405 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 73.41 110.644 -174.462 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.56 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.578 ' HB3' HD22 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' PRO . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 51.3 113.816 178.221 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 71.14 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 74.13 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 64.22 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.446 ' HG3' HD11 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 72.24 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 73.31 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.12 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 72.34 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 54.23 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 74.43 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 70.5 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 HG23 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 53.0 112.879 179.19 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 42.0 pt . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 112.447 0.536 . . . . 71.23 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 65.41 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 55.22 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 52.03 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 34.04 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.524 HG23 HG22 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 74.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.569 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 74.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.653 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 71.25 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 34.32 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.487 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 63.03 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 52.11 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.653 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.11 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.42 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.23 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.789 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.42 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' HD23 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 71.13 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.655 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 71.32 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.32 112.881 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.02 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 42.33 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 62.32 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.789 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 74.43 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.531 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.481 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 63.44 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.482 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 63.32 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.599 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 33.21 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.599 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 62.22 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.482 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.11 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.446 HD11 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 61.44 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 72.11 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.576 ' HG2' HD21 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 64.33 110.0 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 73.23 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 44.41 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 62.11 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.628 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.41 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 54.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 42.54 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.6 ' HB2' HD11 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 63.34 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 45.45 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' B' ' 140' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.56 1.365 0 CA-C-O 121.052 0.454 . . . . 63.54 112.117 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.523 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 73.23 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' SER . . . . . 0.439 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 65.25 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.523 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 61.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 50.45 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.585 HD23 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.61 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.46 HG11 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 51.11 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.401 ' HA ' ' CE1' ' B' ' 87' ' ' TYR . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.509 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 71.51 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.53 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 60.45 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.597 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 74.42 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.446 ' HB2' HD13 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 71.5 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 61.54 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' HD11 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 60.21 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 61.23 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.567 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 71.24 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 70.21 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 51.55 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.729 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 54.02 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.626 ' HB3' HD21 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.63 HG22 HG23 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 70.42 111.522 173.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 73.21 111.829 177.949 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.438 HD12 ' HD2' ' B' ' 59' ' ' ARG . 18.8 pt . . . . . 0 CA--C 1.564 1.502 0 N-CA-C 112.61 0.596 . . . . 64.42 112.61 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.614 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 63.2 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.451 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 72.25 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 50.24 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.614 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.61 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 64.31 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.63 HG23 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 71.32 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 54.2 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.729 HG21 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 64.02 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 60.31 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.641 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 31.24 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.641 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 60.23 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 73.04 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 54.22 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 73.2 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 61.32 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 62.3 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.502 HD21 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 71.22 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 73.25 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.21 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.434 ' HG3' HD22 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 71.13 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.585 HD12 HD23 ' B' ' 21' ' ' LEU . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 52.22 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 72.55 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 65.4 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 54.4 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 15.41 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 73.23 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 72.23 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 64.31 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 42.12 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 72.11 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 107' ' ' ILE . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 71.32 113.062 177.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.402 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.41 ' O ' HD13 ' B' ' 106' ' ' ILE . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 65.34 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 64.34 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 51.55 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 54.41 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 74.52 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 72.04 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 60.3 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.674 ' SD ' HD21 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 121' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.502 ' HG2' HD21 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 73.43 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.521 HG22 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 65.32 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 53.42 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 62.14 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 42.42 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 70.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 72.22 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 71.32 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.496 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 62.33 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 72.41 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.441 ' HD3' ' HG3' ' A' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 71.24 111.073 175.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.439 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 112.853 0.686 . . . . 74.54 112.853 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 64.43 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 63.21 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 74.31 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 72.25 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 72.43 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 61.45 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 51.5 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 63.34 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.597 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 73.13 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 73.41 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD3' HG22 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.7 HD11 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.62 HG22 HD11 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 51.3 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 71.14 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 74.13 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 64.22 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 72.24 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 73.31 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG22 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.12 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 72.34 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 54.23 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.603 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 74.43 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 70.5 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.508 ' OE1' HG13 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.667 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 53.0 111.974 178.005 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 CA--C 1.562 1.436 0 N-CA-C 112.958 0.725 . . . . 71.23 112.958 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 65.41 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 55.22 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 52.03 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 34.04 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.7 HD21 HD11 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 74.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 74.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.43 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 71.25 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 75' ' ' GLY . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 34.32 111.107 173.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.439 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.463 ' H ' HG23 ' A' ' 71' ' ' THR . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.482 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 63.03 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 52.11 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.11 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.23 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 71.13 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.546 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 71.32 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.32 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.571 HG23 HG23 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.02 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.571 HG23 HG23 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 42.33 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.546 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.628 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 62.32 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 74.43 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.431 ' O ' HD13 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 63.44 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.4 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 63.32 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.694 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 33.21 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.694 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 62.22 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.11 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 61.44 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 72.11 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 64.33 110.108 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 73.23 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 44.41 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 62.11 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.41 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 54.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.646 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 42.54 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.722 ' HB2' HD11 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 63.34 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 45.45 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 73.23 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.598 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 65.25 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.598 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 61.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 50.45 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.406 ' HB ' HD12 ' B' ' 25' ' ' ILE . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 51.11 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.652 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 71.51 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.822 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 60.45 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 74.42 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 71.5 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 61.54 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 60.21 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 61.23 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 71.24 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 70.21 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 51.55 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.498 ' O ' HG22 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 54.02 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.56 ' HB3' HD21 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 70.42 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 73.21 112.643 -176.176 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 37.9 pt . . . . . 0 CA--C 1.554 1.11 0 N-CA-C 112.634 0.605 . . . . 64.42 112.634 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.542 ' O ' HG23 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 63.2 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 72.25 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 50.24 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' B' ' 48' ' ' VAL . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.822 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 64.31 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.429 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' B' ' 67' ' ' ILE . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 71.32 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 54.2 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 64.02 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 60.31 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.509 HG21 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 31.24 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 60.23 111.524 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 73.04 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 54.22 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 73.2 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' PHE . . . . . 0.473 ' O ' HD13 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 81' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 61.32 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.652 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 62.3 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.532 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 71.22 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' TYR . . . . . 0.434 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 73.25 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.485 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.21 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 71.13 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 52.22 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.601 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 72.55 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HD3' HD13 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 65.4 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.438 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 54.4 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 15.41 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 73.23 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 72.23 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.601 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 64.31 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 42.12 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 72.11 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.491 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 71.32 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.555 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 65.34 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 64.34 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 51.55 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 54.41 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.555 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 74.52 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 72.04 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 60.3 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 73.43 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.436 ' HE2' ' HB2' ' B' ' 124' ' ' MET . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 65.32 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 53.42 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 62.14 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 42.42 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.534 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 70.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 72.22 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 71.32 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.534 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 62.33 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.632 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.722 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 72.41 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm . . . . . 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 71.24 112.524 -170.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 CA--C 1.554 1.131 0 CA-C-O 120.145 0.021 . . . . 74.54 111.01 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 64.43 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.419 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 63.21 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 74.31 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 72.25 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 72.43 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 61.45 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 51.5 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 63.34 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.595 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 73.13 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.402 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 73.41 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.742 ' HA ' HG12 ' A' ' 30' ' ' ILE . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.656 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 51.3 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.417 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 71.14 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.429 HD13 HD11 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 74.13 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 64.22 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 72.24 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 73.31 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.551 HG12 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.656 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.12 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 72.34 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 54.23 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 74.43 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 70.5 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 53.0 110.487 165.946 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.569 0.581 . . . . 71.23 112.569 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.537 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 65.41 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.702 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 55.22 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.735 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 52.03 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 34.04 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.429 HD11 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 74.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 74.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.43 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 71.25 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 34.32 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 77' ' ' VAL . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.551 ' HG2' HG12 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 63.03 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 52.11 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.11 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . 0.404 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.23 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.404 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.538 ' HB3' HD23 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 71.13 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 71.32 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.49 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.32 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.02 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 42.33 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 62.32 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 74.43 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.444 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 63.44 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 63.32 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 33.21 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 62.22 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.476 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.11 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 61.44 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 72.11 111.831 178.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 64.33 110.24 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 73.23 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 44.41 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.446 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 62.11 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.3 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.41 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 54.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 42.54 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.614 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 63.34 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.556 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 45.45 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 73.23 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 65.25 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 61.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 50.45 111.104 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.625 HD23 HD12 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.441 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.771 HG11 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 51.11 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 71.51 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 60.45 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.478 ' HA ' HD12 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 74.42 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 71.5 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 61.54 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.43 ' HG3' HD21 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 60.21 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.617 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 61.23 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.438 HD12 HD21 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 71.24 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 70.21 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 51.55 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 47' ' ' GLN . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 54.02 111.912 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 44' ' ' ASP . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 70.42 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 73.21 109.525 168.652 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.542 HD12 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 64.42 113.61 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 63.2 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 72.25 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 50.24 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.562 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.492 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 64.31 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 71.32 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 54.2 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 64.02 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.446 HD21 HD13 ' B' ' 34' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 60.31 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 31.24 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 60.23 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 73.04 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 54.22 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 73.2 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 61.32 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 62.3 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 71.22 110.463 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 73.25 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 88' ' ' PRO . . . . . 0.466 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.21 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.558 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 71.13 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.771 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 52.22 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.511 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 72.55 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 65.4 112.842 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 54.4 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 15.41 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 73.23 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 72.23 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.511 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 64.31 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 42.12 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.425 ' HD2' ' HB2' ' B' ' 99' ' ' PRO . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 72.11 110.858 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 71.32 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.444 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 65.34 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 64.34 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 51.55 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 54.41 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 74.52 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 72.04 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.43 HD21 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 60.3 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.518 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 73.43 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.518 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 65.32 110.736 -176.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 53.42 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 62.14 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 42.42 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.627 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.3 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 70.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 72.22 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 71.32 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.627 HG22 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 62.33 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 72.41 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? . . . . . 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 71.24 111.46 -174.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 112.6 0.593 . . . . 74.54 112.6 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 64.43 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 63.21 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 74.31 111.022 172.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 72.25 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 72.43 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 61.45 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 51.5 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 25' ' ' ILE . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 63.34 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.553 HG11 HD21 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 73.13 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 73.41 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.466 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.743 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.466 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 51.3 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 71.14 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.471 HD13 HD11 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 74.13 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 64.22 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HG3' HD11 ' A' ' 118' ' ' LEU . 26.8 mm-40 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 72.24 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 73.31 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.12 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 72.34 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 54.23 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 74.43 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 70.5 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 53.0 112.798 -175.961 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.453 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.564 1.499 0 N-CA-C 113.556 0.947 . . . . 71.23 113.556 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 65.41 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 55.22 111.433 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.743 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 52.03 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 34.04 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 74.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 74.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.43 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 71.25 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 34.32 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 63.03 112.706 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.436 ' HA ' HD12 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 52.11 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.495 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.11 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.23 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 71.13 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 71.32 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.32 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 90' ' ' LEU . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.02 112.618 175.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 42.33 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 98' ' ' GLU . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 62.32 109.869 162.316 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 74.43 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.495 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 63.44 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 63.32 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.406 HG23 ' HG3' ' A' ' 112' ' ' GLU . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 33.21 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.406 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 62.22 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.11 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.569 HD11 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 61.44 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 72.11 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 64.33 110.552 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 73.23 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 44.41 110.931 173.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 62.11 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.555 ' HA ' HG22 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.41 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 54.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 42.54 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 63.34 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 45.45 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 73.23 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 65.25 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.473 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 61.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 50.45 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.61 HD23 HD12 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.447 HG11 HD21 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 51.11 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.508 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 71.51 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.582 ' HB3' HD22 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 60.45 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 74.42 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 71.5 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 61.54 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 60.21 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 61.23 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 71.24 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 70.21 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 51.55 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 54.02 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 70.42 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 73.21 111.769 170.774 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.403 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.2 pp . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 112.352 0.501 . . . . 64.42 112.352 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 63.2 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 72.25 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 50.24 111.94 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.445 ' HB3' HG13 ' B' ' 48' ' ' VAL . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 64.31 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 71.32 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 54.2 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 64.02 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 60.31 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 31.24 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 60.23 111.448 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.455 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 73.04 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.479 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 54.22 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 73.2 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 61.32 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 62.3 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 71.22 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 73.25 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.41 ' HB3' HD23 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.21 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 71.13 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.61 HD12 HD23 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 52.22 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 72.55 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.585 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 65.4 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 54.4 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 15.41 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 73.23 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 72.23 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.406 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 64.31 113.251 170.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 42.12 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 72.11 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.469 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 71.32 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 105' ' ' MET . . . . . 0.479 ' HG2' HG12 ' B' ' 77' ' ' VAL . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 65.34 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 64.34 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 110' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' B' ' 36' ' ' GLN . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.404 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 51.55 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 54.41 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 74.52 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 72.04 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 60.3 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.481 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 73.43 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.481 HG22 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.4 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 65.32 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 53.42 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 62.14 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 42.42 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.6 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 70.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 72.22 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 71.32 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 62.33 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 72.41 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm . . . . . 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 71.24 111.565 -171.921 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 CA--C 1.562 1.433 0 N-CA-C 113.655 0.983 . . . . 74.54 113.655 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 64.43 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 63.21 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 74.31 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 72.25 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 72.43 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 61.45 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 51.5 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.473 HD23 HD12 ' A' ' 90' ' ' LEU . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 63.34 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.711 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.657 HG11 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 73.13 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 73.41 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 51.3 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 71.14 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 74.13 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 64.22 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 110' ' ' SER . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 72.24 112.002 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 73.31 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.12 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 72.34 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 54.23 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.402 ' O ' HG22 ' A' ' 48' ' ' VAL . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 74.43 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.437 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 70.5 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.676 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.494 HD21 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 53.0 110.885 171.771 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 71.23 113.108 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.711 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 65.41 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 55.22 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 34.04 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 74.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 74.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.581 HD13 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.43 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 71.25 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 34.32 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 63.03 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 52.11 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HB2' HD13 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.11 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.23 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 71.13 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.447 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.54 ' HG3' HD22 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.657 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.564 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.586 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 71.32 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.484 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.32 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.44 HG22 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.02 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 42.33 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.586 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 62.32 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.416 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 74.43 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 63.44 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 63.32 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 103' ' ' PHE . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 33.21 112.614 -176.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.51 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 62.22 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.477 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.11 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 61.44 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.493 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 72.11 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 64.33 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 73.23 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 44.41 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 62.11 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.617 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.41 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 54.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.617 HG22 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 42.54 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 63.34 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.603 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 45.45 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.764 0.653 . . . . 63.54 112.764 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.405 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 73.23 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.406 HD23 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 65.25 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.411 ' O ' HG23 ' B' ' 22' ' ' THR . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 61.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 50.45 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.51 HD23 HD12 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.488 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.78 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.451 HG11 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 51.11 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 71.51 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.586 ' HD3' HG22 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.512 ' HB2' HD11 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 60.45 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.55 HG23 ' O ' ' B' ' 27' ' ' PRO . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 74.42 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 71.5 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 61.54 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 60.21 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 61.23 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 74' ' ' LYS . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 71.24 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 70.21 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 51.55 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.514 ' O ' HG22 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 54.02 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.612 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 70.42 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 73.21 112.372 178.628 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 64.42 113.518 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.491 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 63.2 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 72.25 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 50.24 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.612 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.586 HG22 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 64.31 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 71.32 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 54.2 110.339 174.45 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 64.02 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 60.31 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 31.24 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.401 ' HB3' HG12 ' B' ' 39' ' ' VAL . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 60.23 111.101 174.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 73.04 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.501 ' HA ' HD12 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 54.22 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' B' ' 105' ' ' MET . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 73.2 112.639 177.055 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 61.32 109.3 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 62.3 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 71.22 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 73.25 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.447 ' HB3' HD23 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.21 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.458 ' HG3' HD22 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 71.13 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.58 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 52.22 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 72.55 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 65.4 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.507 HG23 HG23 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 54.4 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.507 HG23 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 15.41 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 73.23 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 72.23 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 64.31 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 42.12 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 72.11 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 71.32 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 105' ' ' MET . . . . . 0.401 ' HG2' ' HB2' ' B' ' 78' ' ' ALA . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.537 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 65.34 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 64.34 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.537 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 51.55 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 54.41 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 74.52 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 72.04 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 60.3 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.4 ' O ' HG13 ' B' ' 123' ' ' VAL . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 73.43 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 119' ' ' LEU . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 65.32 110.958 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 53.42 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 62.14 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' B' ' 126' ' ' LEU . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 42.42 111.314 173.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 126' ' ' LEU . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 70.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 72.22 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 71.32 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 62.33 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.603 ' HB2' HD11 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 72.41 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 71.24 111.538 -176.152 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 111.638 0.236 . . . . 74.54 111.638 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 64.43 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 63.21 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 74.31 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 72.25 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.408 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 72.43 112.893 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.535 ' HG2' HD13 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 61.45 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 51.5 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.482 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 63.34 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.566 HG11 HD21 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 73.13 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 73.41 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.732 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.565 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.554 HG22 HD11 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 51.3 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 71.14 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.486 HD13 HD21 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 74.13 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 64.22 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HG3' HD11 ' A' ' 118' ' ' LEU . 28.8 mm-40 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 72.24 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.544 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 73.31 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.51 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.554 HD11 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.12 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 72.34 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 54.23 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 74.43 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 70.5 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 53.0 111.049 176.017 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.751 0.278 . . . . 71.23 111.751 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.732 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 65.41 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 55.22 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.565 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 52.03 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 34.04 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.449 HD11 HD12 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.535 HD13 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 74.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 74.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.486 HD21 HD13 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.43 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 71.25 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 34.32 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.51 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 63.03 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.498 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 52.11 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.11 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.497 HD23 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.23 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.584 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.418 ' HB3' HD23 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 71.13 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.621 HD13 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 71.32 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.621 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.32 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.02 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.406 HG23 HG23 ' A' ' 94' ' ' VAL . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 42.33 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 62.32 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.584 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 74.43 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 63.44 111.233 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 63.32 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.544 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 33.21 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 62.22 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.11 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 61.44 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 72.11 113.039 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 64.33 110.63 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 73.23 111.321 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 44.41 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 62.11 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.41 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 54.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.494 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 42.54 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.592 ' HB2' HD11 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 63.34 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 45.45 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.409 ' HD2' HD23 ' B' ' 137' ' ' LEU . 63.9 tttm . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' TRP . . . . . 0.466 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 73.23 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 65.25 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 61.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 50.45 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.573 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.405 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.577 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.676 HG11 HD21 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 51.11 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 HD11 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 71.51 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.664 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' SER . . . . . 0.502 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 60.45 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 74.42 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' B' ' 40' ' ' LEU . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 71.5 112.113 176.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 61.54 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 60.21 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 61.23 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.515 HD11 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 71.24 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 70.21 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 51.55 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 54.02 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 70.42 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 73.21 111.064 173.113 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.56 1.353 0 CA-C-O 121.364 0.602 . . . . 64.42 111.175 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 63.2 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.577 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 72.25 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 50.24 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.58 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.664 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 64.31 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.472 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 71.32 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.466 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 54.2 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 64.02 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.436 HD21 HD12 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 60.31 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.593 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 31.24 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.593 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 60.23 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 73.04 111.565 173.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 54.22 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 73.2 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 61.32 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.5 HD11 HD13 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 62.3 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 71.22 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 73.25 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD23 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.21 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 71.13 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.676 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 52.22 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.444 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 72.55 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 65.4 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.456 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 54.4 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 15.41 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 73.23 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.506 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 72.23 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 64.31 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 42.12 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 72.11 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.659 ' HD2' HD21 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 71.32 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.461 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.601 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 65.34 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 64.34 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 112' ' ' GLU . . . . . 0.601 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 51.55 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 54.41 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.659 HD21 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 74.52 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 72.04 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 60.3 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.57 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 73.43 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.523 HG22 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 65.32 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 53.42 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 62.14 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 42.42 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.715 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 70.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 72.22 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 71.32 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.715 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 62.33 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.545 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 72.41 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 71.24 112.892 171.402 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 64.43 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 63.21 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 74.31 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 72.25 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 72.43 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 61.45 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.47 HG21 ' NZ ' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 51.5 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 63.34 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.759 HG11 HD21 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 73.13 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.556 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 73.41 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.737 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HG3' HG23 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.606 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.602 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 51.3 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 71.14 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 74.13 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 64.22 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HB2' HD11 ' A' ' 118' ' ' LEU . 32.6 mm-40 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 72.24 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 73.31 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.12 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 72.34 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 54.23 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HB2' HG21 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 74.43 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 70.5 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 53.0 111.281 172.494 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 CA--C 1.554 1.132 0 CA-C-O 121.286 0.565 . . . . 71.23 111.625 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 65.41 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.562 ' HG3' HG13 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 55.22 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.658 HG22 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 52.03 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 34.04 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 74.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.459 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 74.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.43 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 71.25 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 34.32 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.533 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 63.03 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 52.11 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.509 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.524 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.11 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.23 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 71.13 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.49 ' HG3' HD22 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.427 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 71.32 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.47 ' NZ ' HG21 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.32 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.02 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 42.33 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.595 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 62.32 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 74.43 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' A' ' 107' ' ' ILE . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.509 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 63.44 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.476 HG21 HD13 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 63.32 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 103' ' ' PHE . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 33.21 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 62.22 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.476 HD13 HG21 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.11 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 61.44 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.469 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 72.11 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.407 ' HB2' ' HE3' ' A' ' 124' ' ' MET . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 64.33 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 73.23 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 44.41 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 62.11 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.701 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.41 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 54.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 42.54 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 63.34 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 45.45 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.58 ' HE2' HD23 ' B' ' 137' ' ' LEU . 91.6 mttt . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 73.23 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.402 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 65.25 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 61.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 50.45 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' SER . . . . . 0.463 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 51.11 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 71.51 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 60.45 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.453 HD11 HD21 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.619 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 74.42 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 71.5 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 61.54 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HB2' HD11 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 60.21 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.535 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 61.23 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.619 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 71.24 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 70.21 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 51.55 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.446 ' O ' HG22 ' B' ' 48' ' ' VAL . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 54.02 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.468 HG23 HD22 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.468 HD22 HG23 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 70.42 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 73.21 110.957 178.801 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.404 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 2.9 pp . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.95 0.405 . . . . 64.42 111.651 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 63.2 115.34 -172.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.471 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 72.25 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.404 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 50.24 110.721 173.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.518 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 64.31 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.453 HD21 HD11 ' B' ' 30' ' ' ILE . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 71.32 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 54.2 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.552 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 64.02 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 60.31 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.552 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 31.24 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.465 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 60.23 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 73.04 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 54.22 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 73.2 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 61.32 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 62.3 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 71.22 111.046 176.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 73.25 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.21 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 71.13 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.446 ' O ' HG13 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 52.22 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 72.55 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 65.4 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.516 HG23 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 54.4 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.516 HG23 HG23 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 15.41 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 73.23 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 72.23 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 64.31 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 42.12 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.469 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 72.11 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.423 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 71.32 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 105' ' ' MET . . . . . 0.465 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.56 HG21 HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 65.34 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 64.34 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 51.55 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 54.41 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.56 HD13 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 74.52 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 72.04 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 60.3 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.416 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 121' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 73.43 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 65.32 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 53.42 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 62.14 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.457 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 42.42 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.455 HG13 HD11 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 70.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.457 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 72.22 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 71.32 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.548 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 62.33 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 72.41 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.467 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt . . . . . 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 71.24 111.079 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.554 1.104 0 N-CA-C 111.99 0.367 . . . . 74.54 111.99 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 64.43 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.427 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 63.21 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 74.31 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 72.25 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 72.43 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.448 ' HG3' HD12 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 61.45 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 51.5 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 17' ' ' PHE . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 63.34 111.319 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.523 HG22 ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.739 HG11 HD21 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 73.13 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 HD11 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 73.41 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.557 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' HD11 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 51.3 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 71.14 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 74.13 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 64.22 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 72.24 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 73.31 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.12 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 72.34 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 54.23 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 74.43 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 70.5 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.579 HG22 HG23 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 28' ' ' SER . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 53.0 112.92 179.158 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 40.6 pt . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 71.23 113.614 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 65.41 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HE3' ' HD2' ' A' ' 27' ' ' PRO . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 55.22 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.557 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 52.03 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 34.04 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.579 HG23 HG22 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 74.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 74.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.43 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 71.25 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 34.32 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 63.03 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 52.11 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.11 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.23 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.405 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 71.13 111.533 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.456 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' HD22 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.739 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 71.32 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.32 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.02 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 42.33 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 62.32 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 102' ' ' VAL . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 74.43 121.139 -164.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 63.44 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.511 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 63.32 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 106' ' ' ILE . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 33.21 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 62.22 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.11 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 61.44 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.513 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 72.11 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 64.33 109.694 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 73.23 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 44.41 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 62.11 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.587 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.2 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.41 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 54.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.587 HG22 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 42.54 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.586 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 63.34 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 45.45 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.553 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.5 mtpm? . . . . . 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 73.23 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 65.25 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 61.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.536 HG21 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 50.45 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.512 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.656 HG11 HD21 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 51.11 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 71.51 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.729 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 60.45 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.439 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 74.42 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 71.5 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 61.54 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 60.21 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 61.23 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 71.24 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ASN . . . . . 0.427 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 7.1 m120 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 70.21 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 42' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 51.55 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 54.02 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.439 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 70.42 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 73.21 112.448 179.588 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.427 HG22 HH11 ' B' ' 59' ' ' ARG . 2.8 pp . . . . . 0 CA--C 1.559 1.315 0 N-CA-C 111.927 0.343 . . . . 64.42 111.927 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 63.2 112.83 -172.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.504 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 72.25 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.427 HH11 HG22 ' B' ' 56' ' ' ILE . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 50.24 111.528 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.729 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.5 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 64.31 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 71.32 111.956 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 54.2 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 64.02 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 60.31 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 31.24 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' HIS . . . . . 0.462 ' O ' HG23 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 60.23 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 73.04 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.462 HG23 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 54.22 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 73.2 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 61.32 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 62.3 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 71.22 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 73.25 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.21 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.403 ' HG3' HD22 ' B' ' 90' ' ' LEU . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 71.13 111.299 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.656 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 52.22 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 72.55 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.536 ' NZ ' HG21 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 65.4 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.461 HG22 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 54.4 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.438 HG23 HG23 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 15.41 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 73.23 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 72.23 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.524 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 64.31 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 42.12 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 72.11 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.428 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 71.32 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.42 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 65.34 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 64.34 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 51.55 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 54.41 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 106' ' ' ILE . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 74.52 111.874 178.232 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 72.04 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 60.3 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.495 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 73.43 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 65.32 110.475 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.495 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 53.42 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 62.14 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.535 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 42.42 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.729 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.6 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 70.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 72.22 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 71.32 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.729 HG22 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 62.33 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 72.41 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.553 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 71.24 110.896 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 64.43 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 63.21 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 74.31 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 72.25 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 72.43 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.594 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 61.45 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 51.5 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.454 HD11 HG11 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 63.34 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.703 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 73.13 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 73.41 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.643 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.48 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.672 HG22 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 51.3 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 71.14 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 74.13 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.403 ' HG2' HD22 ' A' ' 40' ' ' LEU . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 64.22 111.216 170.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 72.24 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.418 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 73.31 112.85 172.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.672 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.12 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 72.34 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 54.23 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 74.43 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.615 ' HB3' HD21 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 70.5 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 19.8 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 53.0 109.531 170.94 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 112.27 0.471 . . . . 71.23 112.27 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 65.41 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 55.22 112.634 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 52.03 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 34.04 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.643 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 74.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 74.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.43 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 71.25 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 34.32 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG23 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.529 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 63.03 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 52.11 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.11 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.23 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 71.13 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD22 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.703 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.624 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 71.32 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 20' ' ' THR . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.32 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.594 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.02 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.446 HG23 HG23 ' A' ' 94' ' ' VAL . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 42.33 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.584 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.584 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 62.32 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.515 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 74.43 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.467 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 63.44 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 63.32 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 33.21 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HA ' HD12 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 62.22 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.11 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 61.44 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.504 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 72.11 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.429 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 64.33 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 73.23 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 44.41 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 62.11 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.41 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 54.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.562 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 42.54 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 63.34 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 45.45 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 73.23 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.432 HD21 HD21 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 65.25 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 61.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.465 HG21 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 50.45 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.694 HD23 HD12 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.485 HG11 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 51.11 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 71.51 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.652 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 60.45 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.47 HG12 ' HA ' ' B' ' 27' ' ' PRO . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 74.42 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 71.5 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 61.54 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.665 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 60.21 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.625 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 61.23 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 71.24 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 70.21 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 51.55 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 54.02 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.6 HG22 HG23 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.528 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 70.42 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 73.21 108.913 163.513 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 64.42 112.715 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 63.2 113.312 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.582 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 72.25 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 50.24 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.652 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 64.31 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.6 HG23 HG22 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 71.32 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 54.2 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 64.02 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 60.31 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 31.24 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.497 ' HB3' HG12 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 60.23 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.445 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 73.04 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 54.22 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 73.2 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.538 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 61.32 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 62.3 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.529 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 71.22 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 73.25 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.21 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 71.13 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.694 HD12 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 52.22 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.463 ' HA ' HG22 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 72.55 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.465 ' HE3' HG21 ' B' ' 20' ' ' THR . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 65.4 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 54.4 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.425 HG23 HG23 ' B' ' 94' ' ' VAL . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 15.41 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 73.23 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 72.23 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.453 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 64.31 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 42.12 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 72.11 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.529 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 71.32 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.517 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 65.34 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 64.34 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.625 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 51.55 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 54.41 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.517 HD13 HG21 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 74.52 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 72.04 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 60.3 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.484 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 73.43 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.468 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 65.32 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 53.42 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 67.7 tp60 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 62.14 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' B' ' 124' ' ' MET . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 42.42 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.491 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 70.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 72.22 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 71.32 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.491 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 62.33 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 72.41 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 71.24 112.615 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.453 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 . . . . . 0 CA--C 1.555 1.165 0 N-CA-C 111.766 0.284 . . . . 74.54 111.766 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 64.43 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 63.21 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 74.31 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 72.25 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 72.43 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.429 ' HA ' HD12 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 61.45 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 51.5 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 63.34 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG11 HD21 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 73.13 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 HD11 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 73.41 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.659 ' HB3' HD22 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.536 HG23 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 51.3 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.444 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 71.14 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 74.13 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 64.22 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 26.2 mm-40 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 72.24 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 73.31 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.12 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 72.34 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 54.23 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 74.43 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 70.5 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 53.0 111.406 174.247 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 71.23 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.64 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 65.41 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 63' ' ' VAL . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 55.22 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 52.03 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 34.04 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.589 HG12 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.659 HD22 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 74.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 74.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.43 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 71.25 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 34.32 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 63.03 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 52.11 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.11 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.589 HD11 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.23 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.62 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 71.13 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' A' ' 90' ' ' LEU . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.441 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 71.32 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.595 ' HD3' HD13 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.32 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.593 HG23 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.02 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.593 HG23 HG23 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 42.33 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.449 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 62.32 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 74.43 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.517 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 63.44 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 63.32 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.666 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 33.21 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.666 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 62.22 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.11 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 61.44 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.48 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 72.11 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 64.33 109.955 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 73.23 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 44.41 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 62.11 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.522 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.41 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 54.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.522 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 42.54 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 63.34 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 45.45 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 113.293 0.849 . . . . 63.54 113.293 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 73.23 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 65.25 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 61.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 50.45 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.524 HG22 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.589 HG11 HD21 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 51.11 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 71.51 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.478 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 60.45 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.522 ' HG3' HG23 ' B' ' 30' ' ' ILE . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 74.42 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.494 HD13 HD21 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 71.5 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 61.54 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.453 ' HG3' HD11 ' B' ' 118' ' ' LEU . 27.0 mm-40 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 60.21 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.61 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 61.23 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.655 HD12 HD11 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 71.24 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 70.21 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 51.55 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 54.02 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.556 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 70.42 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 73.21 112.452 170.212 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 112.134 0.42 . . . . 64.42 112.134 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.404 ' O ' HG23 ' B' ' 61' ' ' VAL . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 63.2 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.469 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 72.25 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 50.24 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.478 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.524 ' HB ' HG22 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 64.31 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.655 HD11 HD12 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 71.32 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 54.2 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 64.02 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.494 HD21 HD13 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 60.31 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 31.24 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' LYS . . . . . 0.577 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 60.23 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 73.04 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 54.22 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 73.2 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 61.32 110.737 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 62.3 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 71.22 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' TYR . . . . . 0.505 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 73.25 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.21 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 71.13 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.589 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 52.22 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.583 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 72.55 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.587 ' HD3' HD13 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 65.4 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.403 HG23 HG23 ' B' ' 95' ' ' THR . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 54.4 112.309 174.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.403 HG23 HG23 ' B' ' 94' ' ' VAL . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 15.41 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 73.23 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 72.23 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 64.31 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 42.12 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 101' ' ' ARG . . . . . 0.436 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 72.11 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.447 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 71.32 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 105' ' ' MET . . . . . 0.461 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.447 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 65.34 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 64.34 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.61 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 51.55 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 54.41 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 74.52 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 72.04 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.453 HD11 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 60.3 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 73.43 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.425 ' HB2' ' HE2' ' B' ' 124' ' ' MET . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 65.32 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 53.42 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 62.14 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 42.42 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 126' ' ' LEU . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.485 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 70.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 72.22 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 71.32 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.485 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 62.33 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.538 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 72.41 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 71.24 110.647 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.492 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.594 0.235 . . . . 74.54 111.412 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 64.43 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 63.21 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 74.31 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 72.25 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 72.43 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' HG12 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 61.45 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.474 HG21 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 51.5 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 63.34 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.725 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.513 HG11 HD21 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 73.13 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 73.41 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.483 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 51.3 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 71.14 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 74.13 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 64.22 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 72.24 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 73.31 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD11 HG22 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.12 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 72.34 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 54.23 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 74.43 112.043 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 70.5 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 53.0 109.856 179.047 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 71.23 113.224 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.725 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 65.41 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 55.22 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.486 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 52.03 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 34.04 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 74.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.444 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 74.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.43 111.411 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLN . . . . . 0.492 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 71.25 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.466 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 34.32 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HE2' ' HB ' ' A' ' 71' ' ' THR . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 63.03 110.751 169.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.61 ' HA ' HD12 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 52.11 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.403 ' OE2' ' HA ' ' A' ' 103' ' ' PHE . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.11 110.851 171.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.23 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 99' ' ' PRO . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HB2' ' HZ ' ' A' ' 103' ' ' PHE . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 71.13 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.614 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 71.32 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.32 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.639 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.02 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.639 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 42.33 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.614 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HA ' ' HG3' ' A' ' 84' ' ' GLU . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 62.32 112.301 167.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 74.43 111.919 -169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 63.44 110.988 176.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 63.32 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.459 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.634 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 33.21 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 62.22 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.11 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 61.44 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 72.11 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.452 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 64.33 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 73.23 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 44.41 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 62.11 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.41 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 54.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 42.54 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.641 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 63.34 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 45.45 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 73.23 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.605 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 65.25 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.504 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.605 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 61.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 50.45 110.364 174.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.693 HG22 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.487 HG11 HD21 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 51.11 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.574 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 71.51 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.597 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 60.45 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.517 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 74.42 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' PRO . . . . . 0.492 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 71.5 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 61.54 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.568 ' HG3' HD21 ' B' ' 118' ' ' LEU . 85.4 mm-40 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 60.21 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.565 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 61.23 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.517 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 71.24 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 70.21 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 51.55 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 54.02 111.768 -173.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.477 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 48' ' ' VAL . . . . . 0.456 HG22 HG23 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 70.42 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 73.21 112.761 178.345 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.94 0.348 . . . . 64.42 111.94 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.415 ' O ' HG23 ' B' ' 61' ' ' VAL . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 72.25 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 50.24 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.693 ' HB ' HG22 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 64.31 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.456 HG23 HG22 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' LEU . . . . . 0.42 HD22 ' HG3' ' B' ' 27' ' ' PRO . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 71.32 111.048 172.405 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 54.2 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 64.02 111.58 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 60.31 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 31.24 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' HIS . . . . . 0.479 ' O ' HG23 ' B' ' 77' ' ' VAL . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 60.23 111.559 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.449 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 73.04 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 54.22 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 73.2 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.512 ' HB2' HG11 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 61.32 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.508 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 62.3 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.548 ' HA ' ' HE1' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 71.22 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 73.25 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.21 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 71.13 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.487 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 52.22 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.47 ' HA ' HG22 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 92' ' ' LYS . . . . . 0.575 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 72.55 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 65.4 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.615 HG23 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 54.4 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.615 HG23 HG23 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 15.41 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 73.23 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 72.23 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 64.31 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 100' ' ' ALA . . . . . 0.406 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 42.12 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 72.11 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.512 HG11 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.42 ' O ' HG12 ' B' ' 107' ' ' ILE . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 71.32 114.626 -169.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 103' ' ' PHE . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 65.34 110.789 172.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 64.34 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.565 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 51.55 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 54.41 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 74.52 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 72.04 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.568 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 60.3 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.478 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 73.43 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.525 HG21 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 65.32 110.389 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 53.42 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 62.14 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 42.42 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.504 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 70.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 72.22 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.528 HD13 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 71.32 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.504 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 62.33 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.61 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 72.41 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 71.24 110.379 178.089 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.556 1.211 0 CA-C-O 120.722 0.296 . . . . 74.54 111.226 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 64.43 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.661 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 63.21 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 74.31 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 72.25 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.661 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 72.43 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 61.45 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 51.5 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.454 HD23 HD12 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 63.34 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 73.13 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.405 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 73.41 110.917 -173.636 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.592 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 51.3 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 71.14 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 74.13 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 64.22 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 118' ' ' LEU . 86.3 mm-40 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 72.24 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.622 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 73.31 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.12 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 72.34 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 54.23 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.504 ' HB3' HD13 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 74.43 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 70.5 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 53.0 112.094 177.025 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.42 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 112.019 0.377 . . . . 71.23 112.019 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 65.41 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 55.22 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.592 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 34.04 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 74.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.504 HD13 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 74.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.43 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.47 ' NH2' HG23 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 71.25 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 34.32 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 63.03 111.009 170.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 52.11 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB2' HG11 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.11 111.621 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 83' ' ' LEU . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.23 110.494 -177.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.47 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.438 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 71.13 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.591 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 71.32 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.531 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.32 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.02 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.689 HG23 HG23 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 42.33 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 62.32 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' VAL . . . . . 0.542 HG11 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 74.43 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' MET . . . . . 0.44 ' HB2' ' HE2' ' A' ' 105' ' ' MET . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 63.44 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.401 ' O ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 63.32 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 33.21 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 62.22 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.11 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.525 HD21 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 61.44 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 72.11 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 119' ' ' LEU . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 64.33 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.439 ' O ' HG23 ' A' ' 130' ' ' VAL . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 73.23 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 44.41 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.527 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 62.11 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.74 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.41 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 54.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 42.54 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 63.34 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 45.45 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.461 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 73.23 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 65.25 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' PHE . . . . . 0.4 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 61.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' THR . . . . . 0.4 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 50.45 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.467 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.685 HG11 HD21 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 51.11 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 71.51 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 60.45 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.518 HG22 HD11 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 74.42 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.464 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.496 HD13 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 71.5 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 61.54 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.614 ' HG3' HD21 ' B' ' 118' ' ' LEU . 80.6 mm-40 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 60.21 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.508 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 61.23 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.518 HD11 HG22 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 71.24 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' HD23 ' B' ' 40' ' ' LEU . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 70.21 110.157 176.313 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 51.55 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 54.02 112.079 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 70.42 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 73.21 110.738 166.152 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 56' ' ' ILE . . . . . 0.429 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp . . . . . 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 64.42 113.954 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 63.2 111.689 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 72.25 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 50.24 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.467 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 64.31 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' B' ' 60' ' ' LYS . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 71.32 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 54.2 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 66' ' ' ASP . . . . . 0.573 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' ILE . . . . . 0.558 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 64.02 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.496 HD21 HD13 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 60.31 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 31.24 114.75 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 60.23 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 73.04 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 54.22 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 73.2 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.532 ' HB2' HG11 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 61.32 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 62.3 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.406 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 71.22 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 73.25 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' TYR . . . . . 0.542 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.21 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 89' ' ' GLN . . . . . 0.425 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 71.13 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.685 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 52.22 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 72.55 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.544 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 65.4 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 94' ' ' VAL . . . . . 0.467 HG23 HG23 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 54.4 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 95' ' ' THR . . . . . 0.467 HG23 HG23 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 15.41 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 73.23 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 98' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 72.23 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 64.31 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 42.12 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 72.11 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 102' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.516 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 71.32 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.435 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.516 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 65.34 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 64.34 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 51.55 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 54.41 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 74.52 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 72.04 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 118' ' ' LEU . . . . . 0.614 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 60.3 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 120' ' ' MET . . . . . 0.447 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 73.43 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.47 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 65.32 110.445 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.459 ' O ' HG23 ' B' ' 130' ' ' VAL . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 53.42 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 127' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 62.14 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 42.42 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 18.9 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 70.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 132' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 72.22 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 71.32 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 62.33 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 72.41 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.461 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 71.24 112.815 -171.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 64.43 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 63.21 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 74.31 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 72.25 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 72.43 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.471 ' HG2' HD12 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 61.45 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 51.5 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.616 HD23 HD12 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 63.34 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.456 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.455 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 73.13 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 73.41 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.782 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 27' ' ' PRO . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 51.3 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 71.14 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 74.13 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 64.22 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 72.24 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 73.31 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.799 HD21 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.12 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 72.34 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 54.23 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.66 ' HB3' HD13 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 74.43 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.799 ' HB3' HD21 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 70.5 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.438 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 53.0 110.734 169.931 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 71.23 114.082 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.654 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.456 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 65.41 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.654 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 55.22 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' VAL . . . . . 0.782 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 52.03 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 34.04 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 74.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 74.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.43 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 71.25 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 34.32 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 63.03 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.414 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 52.11 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.11 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.23 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TYR . . . . . 0.532 ' HB3' HD23 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 71.13 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' PRO . . . . . 0.763 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD22 ' A' ' 90' ' ' LEU . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 95' ' ' THR . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LYS . . . . . 0.409 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 71.32 112.224 177.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.436 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.32 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.02 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 42.33 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.467 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 62.32 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.763 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 74.43 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . 0.438 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 63.44 111.412 170.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 63.32 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.481 HG23 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 33.21 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.481 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 62.22 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' LEU . . . . . 0.457 ' HB2' HD12 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.11 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 61.44 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.406 ' O ' HG22 ' A' ' 123' ' ' VAL . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 72.11 112.895 176.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' VAL . . . . . 0.496 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' MET . . . . . 0.426 ' HE2' ' HB2' ' A' ' 124' ' ' MET . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 64.33 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 73.23 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 44.41 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 62.11 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLN . . . . . 0.545 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.41 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 54.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 42.54 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.547 ' HB2' HD11 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 63.34 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 137' ' ' LEU . . . . . 0.507 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 45.45 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' LYS . . . . . 0.445 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.2 mtpm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 73.23 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 65.25 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.42 ' O ' HG23 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 61.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 50.45 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' LEU . . . . . 0.731 HD23 HD12 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' THR . . . . . 0.566 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' VAL . . . . . 0.506 HG11 HD21 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 51.11 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' ASP . . . . . 0.454 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 71.51 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.853 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 60.45 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ILE . . . . . 0.691 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 31' ' ' THR . . . . . 0.411 ' HA ' HD13 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 74.42 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.543 HD13 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 71.5 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 61.54 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 60.21 111.226 170.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 61.23 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 71.24 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 70.21 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 51.55 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 54.02 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.563 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 70.42 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 73.21 110.308 167.206 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.494 1.739 0 N-CA-C 111.979 0.363 . . . . 64.42 111.979 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 57' ' ' ARG . . . . . 0.454 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 63.2 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 58' ' ' LYS . . . . . 0.519 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 72.25 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 50.24 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.428 ' HD2' ' HD2' ' B' ' 27' ' ' PRO . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 61' ' ' VAL . . . . . 0.853 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 64.31 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 71.32 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 65' ' ' LEU . . . . . 0.408 HD12 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 54.2 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 64.02 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' LEU . . . . . 0.543 HD11 HD13 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 60.31 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 70' ' ' ARG . . . . . 0.566 ' HG3' HG23 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.566 HG23 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 31.24 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 60.23 111.297 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 73.04 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 54.22 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 73.2 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 81' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 61.32 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 62.3 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.624 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 71.22 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 73.25 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.21 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 71.13 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 90' ' ' LEU . . . . . 0.731 HD12 HD23 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 52.22 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 91' ' ' TYR . . . . . 0.403 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 72.55 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 93' ' ' LYS . . . . . 0.453 ' HD2' HD13 ' B' ' 90' ' ' LEU . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 65.4 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 54.4 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 15.41 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 73.23 111.997 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 72.23 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 99' ' ' PRO . . . . . 0.403 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 64.31 112.654 172.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 42.12 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 72.11 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 71.32 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 106' ' ' ILE . . . . . 0.516 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 65.34 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 64.34 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 51.55 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 54.41 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 115' ' ' LEU . . . . . 0.516 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 74.52 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 72.04 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 60.3 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.624 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 73.43 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 123' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 124' ' ' MET . . . . . 0.437 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 65.32 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 126' ' ' LEU . . . . . 0.418 ' O ' HG23 ' B' ' 130' ' ' VAL . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 53.42 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 127' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 62.14 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 128' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 129' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 42.42 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 130' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 126' ' ' LEU . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 131' ' ' GLN . . . . . 0.592 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 70.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 72.22 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 133' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 71.32 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 134' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 62.33 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 136' ' ' LEU . . . . . 0.507 ' HB2' HD11 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 137' ' ' LEU . . . . . 0.547 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 72.41 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 140' ' ' LYS . . . . . 0.445 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 71.24 113.775 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.676 0 CA-C-O 119.789 -0.451 . . . . 74.14 113.022 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t 60.25 -170.04 0.15 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.157 0.983 . . . . 73.52 110.922 -173.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -157.16 -166.31 2.03 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 121.765 -0.584 . . . . 72.41 110.202 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -133.65 -22.97 1.86 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.179 0.592 . . . . 63.31 111.771 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.7 147.66 29.38 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.907 0.706 . . . . 54.42 112.907 -173.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -96.51 104.84 16.85 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.962 0.905 . . . . 72.04 110.456 -177.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -168.2 173.75 7.64 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.021 0.528 . . . . 73.33 110.428 177.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.6 -28.78 68.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.053 0.541 . . . . 74.54 111.082 169.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 64.43 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.591 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 63.21 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 74.31 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 72.25 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 72.43 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 61.45 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 51.5 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 63.34 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.643 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.556 HG11 HD21 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 73.13 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 73.41 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 HD11 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 51.3 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 71.14 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 74.13 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 64.22 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 72.24 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 73.31 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.12 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 72.34 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 54.23 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 74.43 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 70.5 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.37 -33.83 73.01 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 53.0 110.744 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.474 ' HB3' ' HE3' ' A' ' 60' ' ' LYS . 37.4 t70 -96.65 107.13 34.62 Favored Pre-proline 0 CA--C 1.559 1.308 0 N-CA-C 108.402 -0.962 . . . . 73.24 108.402 164.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -65.45 -34.16 44.24 Favored 'Trans proline' 0 CA--C 1.559 1.771 0 C-N-CA 122.189 1.926 . . . . 74.43 113.574 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 55' ' ' VAL . 66.1 m-20 -84.08 -172.32 4.09 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.603 0.716 . . . . 71.45 112.39 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.7 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -91.64 17.97 8.12 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.347 1.059 . . . . 73.21 112.881 176.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 53' ' ' ASN . 50.9 t -57.88 -49.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 C-N-CA 123.327 0.651 . . . . 63.23 112.109 -172.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.475 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt -118.84 28.16 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.729 0.812 . . . . 71.23 111.676 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 65.41 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.475 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.595 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 55.22 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.643 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 52.03 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 34.04 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 74.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 74.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.423 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.43 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 71.25 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 34.32 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.591 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 63.03 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 52.11 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.407 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.11 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.23 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.503 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 71.13 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.56 ' HG3' HD22 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.56 HD22 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 71.32 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.32 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.02 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 42.33 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.455 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 62.32 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 74.43 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.499 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.407 ' HB3' ' OE1' ' A' ' 81' ' ' GLU . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 63.44 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 63.32 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 33.21 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 62.22 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.11 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 61.44 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.636 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 72.11 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.503 ' HG2' HD21 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 64.33 110.985 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 73.23 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 44.41 110.367 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 62.11 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.41 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 54.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 42.54 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.42 ' HB2' HD11 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 63.34 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 45.45 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.439 ' HD2' HD23 ' B' ' 137' ' ' LEU . 10.0 mtpm? -110.21 -164.13 0.9 Allowed 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -69.66 -14.66 62.92 Favored 'General case' 0 CA--C 1.565 1.528 0 C-N-CA 125.098 1.359 . . . . 62.43 113.48 172.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 N--CA 1.496 1.864 0 C-N-CA 124.382 1.073 . . . . 73.44 112.63 -178.444 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 113.687 0.235 . . . . 64.41 113.687 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.1 t -86.03 71.74 10.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.272 0.629 . . . . 74.14 111.472 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 62.45 14.02 6.6 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 124.878 1.271 . . . . 72.11 114.112 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -58.42 -22.03 52.88 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.928 1.291 . . . . 75.11 113.871 -177.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -63.41 161.43 14.24 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.444 1.097 . . . . 72.3 111.789 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -124.31 103.54 8.28 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.726 -0.609 . . . . 64.42 110.062 175.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -161.03 158.87 28.58 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.552 0.741 . . . . 63.54 109.658 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.528 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 73.23 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 65.25 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 61.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.445 HG21 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 50.45 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.552 HD23 HD12 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.47 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.76 HG11 HD21 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 51.11 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.471 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 71.51 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.688 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 60.45 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.471 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.688 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 74.42 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.474 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 71.5 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 61.54 110.97 169.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.58 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 60.21 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.605 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 61.23 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.476 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 71.24 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 70.21 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 51.55 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.428 ' HB3' HG21 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 54.02 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.476 ' HB3' HD21 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 70.42 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -59.02 -33.52 70.84 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 73.21 109.851 168.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -105.02 105.56 52.0 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 124.622 1.169 . . . . 71.51 108.188 161.439 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.57 -27.09 81.34 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.948 2.432 . . . . 74.43 112.936 175.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.407 ' HB2' HG23 ' B' ' 55' ' ' VAL . 13.4 m-80 -75.69 -176.77 3.43 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.787 0.835 . . . . 61.14 112.238 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.459 ' O ' ' HD2' ' B' ' 57' ' ' ARG . 40.3 mt -106.69 44.97 1.01 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.426 -0.806 . . . . 71.35 109.944 174.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.407 HG23 ' HB2' ' B' ' 53' ' ' ASN . 59.7 t -82.94 -55.98 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 122.063 -0.398 . . . . 75.11 110.56 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.426 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt -94.94 25.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 64.42 112.798 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 63.2 114.231 -178.289 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 72.25 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 50.24 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.577 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 64.31 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 71.32 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.528 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 54.2 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.428 HG21 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 64.02 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 60.31 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 31.24 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 60.23 112.147 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 73.04 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.58 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 54.22 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 73.2 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 61.32 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 62.3 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 71.22 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 73.25 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.512 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.21 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.455 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 71.13 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.76 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 52.22 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 72.55 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' B' ' 20' ' ' THR . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 65.4 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 54.4 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.504 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 15.41 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.504 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 73.23 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 72.23 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 64.31 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 42.12 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.636 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 72.11 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.465 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 71.32 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.426 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.466 HD12 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 65.34 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 64.34 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.466 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 51.55 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 54.41 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 74.52 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 72.04 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 60.3 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.488 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 73.43 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.516 HG13 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 65.32 109.815 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 53.42 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 62.14 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.448 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 42.42 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.606 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 70.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 72.22 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.448 HD21 ' HE3' ' B' ' 129' ' ' LYS . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.606 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 62.33 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.48 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 133' ' ' LEU . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 72.41 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -103.89 -170.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 71.24 112.116 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -101.0 13.42 35.26 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.609 0.764 . . . . 51.42 112.616 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.709 -0.662 . . . . 72.2 110.802 177.015 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 112.917 -0.073 . . . . 74.14 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -173.89 144.76 1.06 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.144 0.977 . . . . 73.52 110.525 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -67.76 -29.74 69.03 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.04 0.536 . . . . 72.41 110.647 170.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -87.63 -67.28 0.83 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.184 0.994 . . . . 63.31 111.331 -175.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 -79.87 136.45 36.68 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 122.617 0.367 . . . . 54.42 111.7 -176.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 53.71 -3.92 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 117.801 2.519 . . . . 72.04 117.801 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 32.55 87.11 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 115.472 1.656 . . . . 73.33 115.472 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -68.92 -15.83 63.59 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.568 0.747 . . . . 74.54 112.127 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 64.43 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 63.21 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 74.31 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 72.25 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 72.43 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 61.45 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 51.5 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 63.34 111.509 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.615 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.427 ' HB ' HD12 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 73.13 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 73.41 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.522 ' O ' HG23 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 51.3 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 71.14 112.401 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 HD21 ' A' ' 68' ' ' LEU . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 74.13 111.748 174.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 64.22 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.431 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 72.24 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 73.31 112.625 174.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.12 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 72.34 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 54.23 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 74.43 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 70.5 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -91.46 -35.48 14.31 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 53.0 113.398 -177.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -42.11 147.39 0.56 Allowed Pre-proline 0 N--CA 1.501 2.079 0 N-CA-C 113.709 1.003 . . . . 73.24 113.709 172.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -75.58 19.51 0.54 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 123.314 2.676 . . . . 74.43 113.748 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.557 ' HB2' HG23 ' A' ' 55' ' ' VAL . 31.3 p-10 -169.96 162.51 9.23 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.808 1.243 . . . . 71.45 110.586 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -114.37 19.81 15.95 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.626 0.771 . . . . 73.21 110.426 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 53' ' ' ASN . 48.0 t -61.46 -30.42 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 123.98 0.912 . . . . 63.23 110.84 172.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp -106.05 26.39 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 C-N-CA 125.244 1.418 . . . . 71.23 112.015 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 65.41 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 55.22 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.467 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 52.03 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 34.04 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 74.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 74.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.43 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 71.25 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 34.32 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 63.03 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 73' ' ' HIS . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 52.11 111.786 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.11 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.23 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HG ' HG21 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 71.13 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.608 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.499 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 71.32 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.32 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.02 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 42.33 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 62.32 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 74.43 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.439 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 63.44 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.549 HG23 HD22 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 63.32 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.426 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 33.21 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.444 ' HA ' HD12 ' A' ' 107' ' ' ILE . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 62.22 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.549 HD22 HG23 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.11 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 61.44 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.483 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 72.11 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 64.33 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 73.23 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 44.41 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.453 HG13 HD11 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 62.11 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.41 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 54.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.532 HD13 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.549 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 42.54 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 63.34 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.649 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 45.45 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -92.29 -178.7 5.02 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -79.63 -6.23 56.68 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 112.722 0.638 . . . . 62.43 112.722 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.423 0.689 . . . . 73.44 109.706 174.972 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 CA-C-O 119.853 -0.415 . . . . 64.41 112.97 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.3 t -123.25 157.61 32.74 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.2 0.6 . . . . 74.14 112.504 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -99.67 -178.76 3.98 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.644 0.778 . . . . 72.11 110.138 167.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -64.68 -61.49 2.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.042 0.537 . . . . 75.11 111.509 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -84.24 147.79 27.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.43 0.692 . . . . 72.3 109.732 171.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 25.5 p-10 -75.92 75.04 2.84 Favored 'General case' 0 CA--C 1.565 1.535 0 CA-C-O 122.487 1.137 . . . . 64.42 111.0 174.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -86.75 110.04 19.64 Favored 'General case' 0 CA--C 1.563 1.456 0 CA-C-N 115.132 -0.94 . . . . 63.54 110.969 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 73.23 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.613 ' HB3' HD11 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 65.25 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 61.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 50.45 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.613 HD11 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.724 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 51.11 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.479 HD11 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 71.51 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.561 ' HD3' HG22 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 60.45 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 74.42 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 71.5 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 61.54 110.779 171.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.4 ' OE1' HD13 ' B' ' 118' ' ' LEU . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 60.21 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.597 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 61.23 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 71.24 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 70.21 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 51.55 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 54.02 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.425 ' HA ' ' HB2' ' B' ' 50' ' ' SER . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.504 HG21 HD13 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 70.42 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t -60.64 -37.47 81.6 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 73.21 112.062 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -79.75 108.75 9.73 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 123.423 0.689 . . . . 71.51 110.094 169.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.78 -43.26 45.51 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.84 2.36 . . . . 74.43 114.183 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -48.56 124.09 7.69 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.475 0.917 . . . . 61.14 113.475 179.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.655 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.7 pt? -72.76 -5.15 35.93 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 114.621 -1.172 . . . . 71.35 112.045 168.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -63.66 -41.28 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.637 0.775 . . . . 75.11 111.031 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp -105.58 23.67 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 124.278 1.031 . . . . 64.42 111.657 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.607 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 63.2 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 72.25 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 50.24 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.561 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 64.31 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.504 HD13 HG21 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 71.32 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 54.2 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 64.02 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 60.31 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 31.24 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 60.23 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.459 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 73.04 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.481 HG23 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 54.22 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 73.2 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 61.32 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 62.3 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 71.22 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 73.25 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.663 ' HB3' HD23 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.21 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 71.13 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.724 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 52.22 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.447 ' HA ' HG22 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 72.55 112.905 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 65.4 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.583 HG23 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 54.4 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.583 HG23 HG23 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 15.41 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 73.23 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 72.23 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 64.31 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.491 ' HB3' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 42.12 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 72.11 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.491 HG23 ' HB3' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.407 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 71.32 114.415 173.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.628 HD12 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 65.34 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 64.34 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.63 ' HA ' HD12 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 51.55 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 54.41 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.628 HD13 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 74.52 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 72.04 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 60.3 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.536 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 73.43 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 65.32 110.419 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 53.42 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 14.6 mm100 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 62.14 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 42.42 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 70.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 72.22 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 71.32 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 62.33 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 72.41 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -72.88 168.44 18.9 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 71.24 110.274 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.96 -26.81 69.0 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.158 0.504 . . . . 51.42 110.762 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.577 1.982 0 C-N-CA 124.263 1.025 . . . . 72.2 111.111 172.812 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.076 0 CA-C-O 120.118 -0.268 . . . . 74.14 113.058 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -151.3 -179.89 7.74 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.78 0.832 . . . . 73.52 110.174 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -67.76 150.45 48.63 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.226 0.61 . . . . 72.41 111.698 171.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -75.19 -72.43 0.3 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.763 0.825 . . . . 63.31 111.64 -176.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -68.35 157.62 35.28 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.686 0.394 . . . . 54.42 110.529 172.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -74.27 82.04 1.85 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.495 0.554 . . . . 72.04 112.495 -172.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -69.6 94.39 0.77 Allowed 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.436 -1.32 . . . . 73.33 107.436 169.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.49 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 -89.03 -6.81 56.9 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 174.732 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 64.43 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.454 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 63.21 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 74.31 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 72.25 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 72.43 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 61.45 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 51.5 111.13 176.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.462 HD23 HD12 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 63.34 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.633 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG11 HD21 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 73.13 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.426 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 73.41 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.704 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 51.3 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.447 ' HB2' HD22 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 71.14 110.275 177.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 74.13 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 64.22 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 73.31 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.12 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 72.34 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 54.23 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 74.43 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 70.5 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -58.49 -33.41 69.77 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 53.0 110.59 168.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.45 126.05 30.46 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.958 1.303 . . . . 73.24 109.242 170.191 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.12 -26.29 4.41 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 C-N-CA 122.656 2.237 . . . . 74.43 115.8 -170.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -61.5 144.51 54.12 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.817 1.043 . . . . 71.45 113.817 -170.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.5 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -83.59 -7.97 59.41 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.392 -0.822 . . . . 73.21 110.666 173.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 t -65.69 -30.87 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.572 0.701 . . . . 63.23 110.685 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt -105.44 24.39 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 124.719 1.207 . . . . 71.23 112.3 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 65.41 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.704 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 55.22 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.633 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 52.03 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 34.04 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 74.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.544 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 74.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.476 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.43 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.544 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 71.25 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 34.32 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 63.03 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 52.11 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.476 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.11 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.23 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.406 ' HG2' ' HB3' ' A' ' 99' ' ' PRO . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 71.13 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 71.32 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.517 ' HD3' HD13 ' A' ' 90' ' ' LEU . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.32 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.02 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 42.33 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.406 ' HB3' ' HG2' ' A' ' 84' ' ' GLU . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 62.32 115.235 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 74.43 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.421 ' O ' HG12 ' A' ' 107' ' ' ILE . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.481 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 63.44 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 63.32 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 33.21 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 107' ' ' ILE . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 62.22 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD12 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.11 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 61.44 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 72.11 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.455 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 64.33 109.935 176.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 73.23 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 44.41 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 62.11 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.647 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.41 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 54.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.47 HD11 HG13 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.647 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 42.54 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.607 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 63.34 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 45.45 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -72.77 142.05 48.11 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -118.93 43.31 2.59 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.6 1.56 . . . . 62.43 107.057 171.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 CA--C 1.564 1.511 0 CA-C-N 114.173 -1.376 . . . . 73.44 112.21 -164.88 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 CA-C-O 120.075 -0.291 . . . . 64.41 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 57.1 m -143.93 174.85 10.48 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.39 0.676 . . . . 74.14 111.625 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.486 ' HB2' ' HE1' ' B' ' 73' ' ' HIS . 3.8 p-10 -99.73 128.97 45.81 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 124.34 1.056 . . . . 72.11 112.335 -173.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -142.93 -9.62 0.79 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.948 0.899 . . . . 75.11 113.388 -171.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -65.26 -179.41 0.59 Allowed 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 113.45 0.907 . . . . 72.3 113.45 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -105.92 86.75 2.44 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.52 0.728 . . . . 64.42 109.125 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ASP . . . . . 0.597 ' H ' ' HB2' ' B' ' 73' ' ' HIS . 8.1 p-10 -149.17 129.16 13.46 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 -172.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.417 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.447 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 73.23 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' VAL . . . . . 0.44 HG11 HG22 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 65.25 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.723 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 61.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 50.45 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.521 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.555 HG11 HD21 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 51.11 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 71.51 109.405 172.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.491 ' HB3' HD11 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 60.45 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 74.42 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.472 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 71.5 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 61.54 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 31.5 mm-40 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 60.21 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 61.23 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 71.24 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 70.21 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 51.55 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.484 ' O ' HG22 ' B' ' 48' ' ' VAL . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 54.02 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.586 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.484 HG22 ' O ' ' B' ' 44' ' ' ASP . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 70.42 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m -80.81 -4.1 53.44 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 73.21 111.587 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.425 ' HB2' ' HZ2' ' B' ' 60' ' ' LYS . 4.8 m-20 -66.21 142.9 98.11 Favored Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 124.395 1.078 . . . . 71.51 110.852 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.41 2.44 6.28 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 C-N-CA 122.835 2.357 . . . . 74.43 113.606 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.403 ' HB2' HG23 ' B' ' 55' ' ' VAL . 25.2 p30 -176.66 -176.92 0.76 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 61.14 110.928 -171.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.449 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.4 pt? -104.32 1.5 30.39 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.52 0.728 . . . . 71.35 110.434 167.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' B' ' 53' ' ' ASN . 42.9 t -64.59 -31.55 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.605 0.762 . . . . 75.11 111.162 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.428 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt -93.32 26.76 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.086 0.955 . . . . 64.42 112.529 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.537 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 63.2 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 72.25 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.428 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 50.24 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 64.31 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.439 HG23 HG12 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HB2' HG11 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 71.32 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.447 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 54.2 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' B' ' 64' ' ' LEU . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 64.02 110.762 174.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.472 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 60.31 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 31.24 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.597 ' HB2' ' H ' ' B' ' 7' ' ' ASP . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 60.23 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.56 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 73.04 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 54.22 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 73.2 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 61.32 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 62.3 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 71.22 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 73.25 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.697 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.21 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.495 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 71.13 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.697 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 52.22 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.465 ' CZ ' HG21 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 72.55 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 65.4 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.723 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 54.4 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.642 HG23 HG23 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 15.41 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 73.23 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 72.23 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.689 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 64.31 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 42.12 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.689 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 72.11 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.427 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 71.32 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.638 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.505 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.638 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 65.34 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 64.34 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 51.55 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.442 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 54.41 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 74.52 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 72.04 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 60.3 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.512 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 73.43 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.512 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 65.32 110.187 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 53.42 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 62.14 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 42.42 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 70.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.508 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 72.22 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.513 HD13 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 71.32 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.533 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 62.33 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 72.41 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -86.96 155.09 20.33 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 71.24 111.944 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.0 72.95 2.22 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.67 -0.863 . . . . 51.42 108.67 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 CA--C 1.564 1.481 0 CA-C-N 115.433 -0.803 . . . . 72.2 110.846 -177.031 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.934 0 CA-C-O 120.4 -0.111 . . . . 74.14 113.207 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 t -73.72 96.84 2.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.124 0.57 . . . . 73.52 111.024 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -82.81 121.61 27.14 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.257 0.551 . . . . 72.41 111.761 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -107.95 -31.3 8.04 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.398 1.079 . . . . 63.31 109.578 171.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -78.82 -13.14 59.97 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.358 1.063 . . . . 54.42 113.286 -172.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -76.28 125.52 29.33 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.877 -0.416 . . . . 72.04 109.877 174.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.03 92.38 2.14 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-O 121.671 0.748 . . . . 73.33 111.51 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.95 -16.5 50.25 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.606 1.163 . . . . 74.54 112.379 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 64.43 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 63.21 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 74.31 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 72.25 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 72.43 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 61.45 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 51.5 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 63.34 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.721 HG11 HD21 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 73.13 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.564 HD13 HD11 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 73.41 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.645 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.548 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 51.3 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 71.14 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 74.13 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.424 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 64.22 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 72.24 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 73.31 112.288 173.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.783 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.12 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 72.34 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.424 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 54.23 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.623 ' HB2' HD13 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 74.43 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.783 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 70.5 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p -61.08 -36.07 78.65 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 53.0 110.398 170.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -95.54 125.38 49.73 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.504 1.122 . . . . 73.24 108.984 166.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -67.64 -32.63 30.25 Favored 'Trans proline' 0 CA--C 1.558 1.705 0 C-N-CA 122.29 1.993 . . . . 74.43 112.247 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.4 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 21.5 m-80 -79.42 176.45 9.68 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.015 0.926 . . . . 71.45 112.052 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -98.37 28.49 4.09 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.039 0.535 . . . . 73.21 112.112 173.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.7 t -66.28 -47.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.892 -0.505 . . . . 63.23 111.182 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt -98.88 25.36 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.42 0.688 . . . . 71.23 112.168 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 65.41 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.645 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 55.22 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 52.03 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 34.04 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.607 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 74.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.623 HD13 ' HB2' ' A' ' 44' ' ' ASP . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 74.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.43 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 71.25 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 34.32 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.481 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 63.03 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.432 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 52.11 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.454 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.543 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.11 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.23 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.69 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 71.13 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.721 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.543 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 71.32 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HB3' ' HE2' ' A' ' 93' ' ' LYS . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.32 112.337 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.02 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 42.33 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.486 ' H ' ' HD2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 62.32 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 74.43 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.571 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.481 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 63.44 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 63.32 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 33.21 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 62.22 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.571 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.11 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.481 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 61.44 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.69 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 72.11 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 64.33 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 73.23 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 44.41 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 62.11 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.73 ' HA ' HG22 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.41 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 54.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.73 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 42.54 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.494 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 63.34 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 45.45 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' HD23 ' B' ' 137' ' ' LEU . 43.3 mtpt -70.65 -176.97 1.41 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -73.28 -17.76 61.29 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 115.553 -0.749 . . . . 62.43 112.442 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 . . . . . 0 CA--C 1.575 1.926 0 CA-C-O 118.57 -0.728 . . . . 73.44 111.598 175.521 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 120.053 -0.304 . . . . 64.41 112.645 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 24.7 t -103.75 18.15 22.56 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.468 0.707 . . . . 74.14 110.82 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -68.98 166.89 17.0 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.885 1.274 . . . . 72.11 112.138 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -104.88 -36.71 7.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.381 0.672 . . . . 75.11 111.791 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.55 15.06 1.79 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 114.18 1.178 . . . . 72.3 114.18 -170.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -71.08 117.93 13.2 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.506 0.67 . . . . 64.42 110.769 172.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ASP . . . . . 0.611 ' H ' ' HA2' ' B' ' 72' ' ' GLY . 29.4 t70 -94.35 82.42 4.07 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.046 0.938 . . . . 63.54 111.221 -170.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 73.23 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.428 HD23 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 65.25 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 61.41 111.998 -173.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 50.45 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.575 ' HA ' HD13 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.549 HG22 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.638 HG11 HD21 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 51.11 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.575 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 71.51 109.713 175.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 60.45 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 74.42 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 71.5 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 61.54 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' B' ' 118' ' ' LEU . 27.7 mm-40 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 60.21 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 61.23 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 71.24 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 70.21 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 51.55 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.624 ' HB3' HD13 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 54.02 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.543 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD11 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 70.42 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -58.44 -34.46 70.84 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 73.21 111.412 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.653 ' HB2' ' HZ1' ' B' ' 60' ' ' LYS . 3.1 m-20 -116.1 106.76 48.85 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.049 -1.093 . . . . 71.51 108.049 171.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.92 -23.42 13.99 Favored 'Trans proline' 0 CA--C 1.557 1.672 0 C-N-CA 122.06 1.84 . . . . 74.43 113.175 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -97.85 176.43 5.8 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.605 0.762 . . . . 61.14 111.593 -171.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.604 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.0 OUTLIER -89.56 26.28 1.76 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.51 0.929 . . . . 71.35 113.51 -174.411 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.4 t -61.09 -51.77 69.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 C-N-CA 123.228 0.611 . . . . 75.11 111.09 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp -122.26 25.24 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.061 0.944 . . . . 64.42 111.856 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.602 ' HB2' ' HA ' ' B' ' 54' ' ' LEU . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 63.2 114.086 -178.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 72.25 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 50.24 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.653 ' HZ1' ' HB2' ' B' ' 51' ' ' ASP . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 64.31 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 71.32 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 54.2 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ASP . . . . . 0.405 ' HA ' ' HG3' ' B' ' 69' ' ' GLN . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 64.02 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 60.31 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' B' ' 66' ' ' ASP . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLY . . . . . 0.611 ' HA2' ' H ' ' B' ' 7' ' ' ASP . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 31.24 113.468 -177.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.463 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 60.23 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 73.04 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 54.22 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 73.2 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.589 ' HB2' HD13 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 61.32 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' B' ' 87' ' ' TYR . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 62.3 111.554 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 71.22 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 73.25 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.528 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.21 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.639 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 71.13 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.639 HD22 ' HG3' ' B' ' 89' ' ' GLN . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 52.22 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 72.55 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 65.4 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.431 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 54.4 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 15.41 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 73.23 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.701 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 72.23 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 64.31 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 42.12 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.69 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 72.11 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' B' ' 115' ' ' LEU . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 71.32 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.541 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.493 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 65.34 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 64.34 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.483 ' HA ' HD12 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 51.55 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 54.41 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.541 HD13 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 74.52 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 72.04 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 60.3 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.545 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 73.43 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.4 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 65.32 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 53.42 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 62.14 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' B' ' 124' ' ' MET . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 42.42 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 70.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 72.22 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.665 HD13 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 71.32 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 62.33 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.523 ' HB2' HD11 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.494 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 72.41 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -84.9 -162.75 0.73 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 71.24 111.583 172.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -57.59 -35.6 70.62 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 123.749 0.82 . . . . 51.42 111.628 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 124.461 1.104 . . . . 72.2 108.688 171.57 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 113.965 0.346 . . . . 74.14 113.965 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -126.34 -177.07 3.85 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.694 0.798 . . . . 73.52 111.342 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.95 153.29 24.0 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.1 0.56 . . . . 72.41 111.882 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -67.68 -27.13 66.58 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.851 0.86 . . . . 63.31 111.406 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -99.38 151.61 20.89 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.487 1.115 . . . . 54.42 110.192 174.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -156.88 -64.85 0.1 Allowed 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.796 0.439 . . . . 72.04 111.675 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -133.41 -2.54 3.08 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 123.17 0.588 . . . . 73.33 111.745 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 -59.72 -11.94 6.12 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.952 0.901 . . . . 74.54 112.803 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 64.43 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.481 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 63.21 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 74.31 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 72.25 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 72.43 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 61.45 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 51.5 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.487 HD23 HD12 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 63.34 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.681 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.52 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG11 HD21 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 73.13 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD11 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 73.41 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 27' ' ' PRO . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 51.3 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 71.14 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD13 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 74.13 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.443 ' HG2' HD22 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 64.22 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.472 ' OE1' HD13 ' A' ' 118' ' ' LEU . 53.2 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 72.24 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.431 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 73.31 114.036 173.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.12 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 72.34 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 54.23 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 74.43 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.407 ' H ' HD21 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 70.5 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -61.11 -36.04 78.63 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 53.0 111.108 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -98.87 119.9 59.96 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.231 1.413 . . . . 73.24 109.196 172.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -74.88 -42.75 0.49 Allowed 'Trans proline' 0 C--N 1.378 2.079 0 C-N-CA 122.921 2.414 . . . . 74.43 115.491 -169.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 51.2 m-20 -69.48 173.94 5.43 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.791 0.663 . . . . 71.45 112.791 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -116.56 26.17 10.06 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.871 0.468 . . . . 73.21 112.22 177.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.9 t -69.2 -27.2 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-O 121.177 0.513 . . . . 63.23 110.281 173.453 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt -116.62 27.35 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.5 0 C-N-CA 124.461 1.105 . . . . 71.23 112.149 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.406 ' HB3' ' HB2' ' A' ' 54' ' ' LEU . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 65.41 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 55.22 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.681 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 52.03 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 34.04 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.545 HD22 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 74.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 74.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.43 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 71.25 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 34.32 110.983 172.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 63.03 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 52.11 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.11 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.23 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 71.13 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 71.32 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.32 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.02 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 42.33 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 62.32 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 74.43 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 63.44 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.743 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 63.32 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 33.21 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.419 ' HA ' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 62.22 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.743 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.44 HG21 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.447 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.11 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.578 HD12 ' HA ' ' A' ' 115' ' ' LEU . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 61.44 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 72.11 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.507 HG13 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.486 ' O ' ' HD3' ' A' ' 128' ' ' LYS . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 64.33 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 62.4 tp60 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 73.23 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 44.41 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.526 HG13 HD11 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 62.11 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.482 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.41 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 54.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 42.54 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 63.34 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 45.45 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -78.76 161.84 26.56 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -54.24 -19.6 5.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.369 1.248 . . . . 62.43 114.369 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 CA--C 1.57 1.724 0 C-N-CA 123.335 0.654 . . . . 73.44 111.208 176.446 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 CA-C-O 120.258 -0.19 . . . . 64.41 112.871 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 73.2 m -140.17 176.84 8.42 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.712 0.805 . . . . 74.14 111.141 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -72.16 136.65 46.54 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.064 0.546 . . . . 72.11 111.29 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -85.44 -48.88 8.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.893 0.877 . . . . 75.11 110.658 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -72.76 93.28 1.64 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.749 0.785 . . . . 72.3 111.809 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -126.7 -157.77 0.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.803 1.241 . . . . 64.42 107.765 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -132.31 44.99 2.82 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 165.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.478 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 73.23 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 65.25 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 61.41 112.011 177.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 50.45 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.606 ' HA ' HD13 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.582 HG22 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.659 HG11 HD21 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 51.11 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.606 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 71.51 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.693 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.482 ' HB3' HD11 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 60.45 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.601 HG22 HD11 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 74.42 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 71.5 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 61.54 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD11 ' B' ' 118' ' ' LEU . 18.7 mm-40 -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 60.21 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.448 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 61.23 112.851 175.338 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.659 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 71.24 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 70.21 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 51.55 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 54.02 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.659 ' HB3' HD21 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.59 HG22 HG23 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 70.42 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -63.25 -33.33 75.26 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 73.21 109.492 161.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -104.24 107.65 58.01 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 125.007 1.323 . . . . 71.51 108.384 164.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.21 -28.58 10.55 Favored 'Trans proline' 0 CA--C 1.555 1.529 0 C-N-CA 121.848 1.699 . . . . 74.43 112.752 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -61.04 -87.87 0.01 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.046 0.939 . . . . 61.14 113.484 -177.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.401 ' H ' ' H ' ' B' ' 55' ' ' VAL . 2.4 pt? 178.52 -7.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 122.967 0.507 . . . . 71.35 111.684 -170.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.401 ' H ' ' H ' ' B' ' 54' ' ' LEU . 62.3 t -56.47 -39.28 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 124.347 1.059 . . . . 75.11 113.06 -168.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.403 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 27.2 pt -112.12 23.97 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 64.42 113.562 -172.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 63.2 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.488 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 72.25 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 50.24 110.943 176.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.52 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.693 HG22 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 64.31 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.59 HG23 HG22 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.418 HD11 HD12 ' B' ' 40' ' ' LEU . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 71.32 111.009 173.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.478 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 54.2 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 64.02 110.693 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.462 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 60.31 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 31.24 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.563 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 60.23 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 73.04 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 54.22 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 73.2 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 61.32 109.868 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 62.3 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.543 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 71.22 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 73.25 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.562 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.21 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.407 ' HG3' HD22 ' B' ' 90' ' ' LEU . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 71.13 111.779 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.659 HD21 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 52.22 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.442 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 72.55 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 65.4 112.488 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 54.4 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 15.41 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' B' ' 92' ' ' LYS . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 73.23 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 72.23 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.415 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 64.31 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 42.12 111.305 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.447 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 72.11 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.543 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 71.32 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.44 HD11 HG21 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 65.34 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 64.34 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 51.55 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 54.41 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 74.52 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.488 HG21 HD11 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 72.04 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.555 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 60.3 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.4 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 73.43 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.452 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 65.32 109.48 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 53.42 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 62.14 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.482 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 42.42 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 70.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 72.22 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.526 HD11 HG13 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 71.32 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 62.33 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.557 ' HB2' HD11 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 72.41 108.331 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.65 161.74 19.11 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 71.24 111.784 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.866 0.867 . . . . 51.42 111.52 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 CA--C 1.57 1.744 0 C-N-CA 123.999 0.92 . . . . 72.2 110.46 174.671 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 120.498 -0.057 . . . . 74.14 112.989 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 77.8 p -114.42 48.41 1.12 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 73.52 110.768 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.21 -44.78 59.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.128 0.971 . . . . 72.41 111.463 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -70.39 -32.64 70.37 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.027 0.531 . . . . 63.31 111.082 175.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 38.1 mm-40 -69.9 146.49 51.19 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.003 0.521 . . . . 54.42 110.493 168.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -71.34 -17.32 62.44 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.898 0.479 . . . . 72.04 111.651 171.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 14.5 t70 64.14 43.63 4.91 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.777 1.231 . . . . 73.33 110.401 -177.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.01 -14.64 58.4 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 114.843 -1.072 . . . . 74.54 112.102 176.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 64.43 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 63.21 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 74.31 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 72.25 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 72.43 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' HB2' HG12 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 61.45 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 51.5 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.504 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 63.34 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 73.13 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.464 HD11 HD22 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 73.41 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 27' ' ' PRO . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 51.3 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 71.14 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 74.13 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 64.22 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 72.24 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 73.31 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.12 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 72.34 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 54.23 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.62 ' HB2' HD13 ' A' ' 67' ' ' ILE . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 74.43 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.758 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 70.5 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.608 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.462 HG22 HG23 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t -94.15 2.55 55.95 Favored 'General case' 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 53.0 109.12 166.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.415 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 5.8 t0 -150.73 122.31 3.95 Favored Pre-proline 0 CA--C 1.559 1.311 0 C-N-CA 125.326 1.45 . . . . 73.24 109.282 -174.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -86.56 -19.2 2.92 Favored 'Trans proline' 0 CA--C 1.565 2.032 0 C-N-CA 122.623 2.216 . . . . 74.43 113.523 172.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -99.35 -155.5 0.51 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.262 1.025 . . . . 71.45 111.211 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.637 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.96 27.49 4.48 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.663 0.785 . . . . 73.21 113.043 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.2 t -69.41 -57.64 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.849 -0.532 . . . . 63.23 111.356 -174.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -117.9 23.43 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 123.233 0.613 . . . . 71.23 111.007 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.655 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 65.41 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 55.22 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.486 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 52.03 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 34.04 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.462 HG23 HG22 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 74.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.62 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 74.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.43 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 71.25 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 34.32 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.588 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 63.03 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' HD12 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 52.11 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.466 ' HB2' HD13 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.11 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.23 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.404 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 71.13 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.504 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 71.32 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.32 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.475 HG12 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.02 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 42.33 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 62.32 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 74.43 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.532 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 63.44 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 63.32 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.536 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 33.21 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 62.22 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.11 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 61.44 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 72.11 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 64.33 110.88 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 53.7 tp60 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 73.23 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 44.41 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 62.11 111.667 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.466 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.41 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 54.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.466 HG22 ' HA ' ' A' ' 131' ' ' GLN . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 42.54 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 63.34 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.675 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 45.45 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -78.53 163.29 25.67 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.77 -40.13 40.29 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.976 0.91 . . . . 62.43 112.353 171.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.565 1.53 0 C-N-CA 124.04 0.936 . . . . 73.44 110.881 174.685 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 113.683 0.233 . . . . 64.41 113.683 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -141.76 -175.35 4.35 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.229 1.012 . . . . 74.14 111.434 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 59.59 -86.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.932 1.293 . . . . 72.11 112.632 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -76.31 -26.87 56.28 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.865 0.866 . . . . 75.11 110.781 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -83.24 87.47 6.94 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.688 0.795 . . . . 72.3 110.267 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.54 66.2 9.38 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.5 -0.773 . . . . 64.42 109.628 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -95.32 130.18 42.19 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 -169.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 73.23 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 65.25 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 61.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 50.45 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.571 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.75 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 51.11 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 71.51 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.733 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 60.45 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 74.42 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 71.5 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.568 ' HD3' HD22 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 61.54 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 60.21 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 61.23 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 71.24 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 70.21 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 51.55 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 54.02 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.598 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 70.42 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -71.55 -30.03 65.42 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 73.21 108.84 163.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.11 119.84 48.68 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 125.013 1.325 . . . . 71.51 109.631 166.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.01 -30.63 6.94 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.337 2.025 . . . . 74.43 113.082 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.52 ' HB2' HG23 ' B' ' 55' ' ' VAL . 13.0 m120 -76.93 -167.48 0.87 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.034 0.933 . . . . 61.14 112.378 -174.486 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.543 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.4 pt? -97.71 19.41 13.68 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.799 -0.563 . . . . 71.35 111.954 172.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' B' ' 53' ' ' ASN . 98.2 t -60.88 -57.82 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.353 0.661 . . . . 75.11 112.073 -174.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt -104.67 23.8 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 64.42 112.273 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 63.2 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.415 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 72.25 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 50.24 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.733 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 64.31 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 71.32 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 54.2 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 64.02 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 60.31 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 31.24 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.496 ' HB3' HG12 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 60.23 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 73.04 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 54.22 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 73.2 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 61.32 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 62.3 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.401 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 71.22 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 73.25 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.662 ' HB3' HD23 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.21 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 71.13 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.75 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 52.22 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.504 ' HA ' HG22 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 72.55 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 65.4 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.526 HG23 HG23 ' B' ' 95' ' ' THR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 54.4 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.526 HG23 HG23 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 15.41 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 73.23 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 72.23 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 64.31 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 42.12 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 72.11 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.541 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 71.32 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.474 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.541 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 65.34 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 64.34 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' B' ' 106' ' ' ILE . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 51.55 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 54.41 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.436 HD21 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 74.52 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 72.04 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 60.3 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.535 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 73.43 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 65.32 109.811 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 53.42 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 62.14 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.539 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 42.42 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.612 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.8 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 70.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 72.22 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 71.32 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.612 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 62.33 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 72.41 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -80.46 -171.45 3.06 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 71.24 111.892 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -49.36 -36.26 21.1 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.391 1.076 . . . . 51.42 113.217 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.76 0.824 . . . . 72.2 110.055 174.533 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.516 -0.233 . . . . 74.14 112.516 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 t -161.37 140.93 10.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.181 0.592 . . . . 73.52 111.55 177.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -87.0 -22.87 25.25 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.526 0.73 . . . . 72.41 110.726 171.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -69.74 -42.31 74.11 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.798 0.839 . . . . 63.31 111.152 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.8 97.16 3.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.916 0.487 . . . . 54.42 110.095 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HB3' ' H ' ' A' ' 73' ' ' HIS . 8.9 m120 -91.55 126.13 36.53 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.983 0.913 . . . . 72.04 110.882 -174.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -76.04 135.76 39.93 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.323 0.582 . . . . 73.33 112.388 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -83.0 -21.1 34.0 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 124.076 0.95 . . . . 74.54 112.215 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 64.43 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.401 ' HB3' ' CG ' ' A' ' 76' ' ' TYR . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 63.21 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 74.31 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 72.25 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 72.43 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.513 ' HD2' HD13 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 61.45 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 51.5 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.557 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 63.34 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.444 HG22 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 73.13 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 73.41 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 51.3 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 71.14 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 74.13 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 64.22 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 72.24 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 73.31 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD11 HG22 ' A' ' 31' ' ' THR . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.12 110.476 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 72.34 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 54.23 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 74.43 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 70.5 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m -88.78 6.78 37.2 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 53.0 112.87 174.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' HA ' HD11 ' A' ' 56' ' ' ILE . 2.9 m-20 -41.39 112.71 1.01 Allowed Pre-proline 0 N--CA 1.499 2.022 0 N-CA-C 114.81 1.411 . . . . 73.24 114.81 -177.124 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -75.75 -31.61 5.17 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.355 2.037 . . . . 74.43 111.575 167.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -142.98 139.83 30.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.389 1.076 . . . . 71.45 109.782 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.431 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -61.92 -0.57 0.5 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.567 1.321 . . . . 73.21 114.567 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 64.6 t -54.79 -29.31 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.631 0 C-N-CA 123.916 0.886 . . . . 63.23 112.352 171.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.457 HD11 ' HA ' ' A' ' 51' ' ' ASP . 30.7 pt -101.55 17.25 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 71.23 114.142 -174.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 65.41 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 55.22 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 52.03 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 34.04 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 74.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 74.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.43 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 71.25 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 34.32 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.438 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 63.03 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 52.11 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.557 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.11 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.23 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.411 ' HB3' HD23 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 71.13 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.423 ' HG3' HD22 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 71.32 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.32 112.862 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 21' ' ' LEU . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.02 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 42.33 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 62.32 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 74.43 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 63.44 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 63.32 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 33.21 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 62.22 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.11 111.666 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 61.44 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 72.11 113.021 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 64.33 110.155 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 73.23 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 44.41 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.488 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 62.11 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.59 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.41 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.528 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 54.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.59 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 42.54 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 63.34 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 45.45 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.655 ' HD3' ' HB2' ' B' ' 142' ' ' ASP . 9.0 mtpm? -88.11 -168.35 2.18 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.43 -19.56 62.97 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.782 0.433 . . . . 62.43 111.771 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 CA--C 1.563 1.446 0 C-N-CA 123.709 0.804 . . . . 73.44 110.005 172.316 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.003 0 CA-C-O 120.271 -0.183 . . . . 64.41 113.205 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t -166.62 103.41 0.59 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.539 0.736 . . . . 74.14 110.46 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -92.54 -31.75 15.1 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.643 0.777 . . . . 72.11 111.742 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -100.94 -57.74 2.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.807 0.843 . . . . 75.11 112.56 -174.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.62 70.72 5.01 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.972 0.892 . . . . 72.3 111.799 -177.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ASN . . . . . 0.475 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 17.6 m120 -91.76 114.93 27.59 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.83 0.852 . . . . 64.42 110.129 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -66.78 132.63 48.46 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 -171.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.444 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 73.23 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 65.25 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 61.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 50.45 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.461 HG21 HD11 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 51.11 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 71.51 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.578 ' HD3' HG22 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 60.45 112.111 -170.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.582 HG22 HD11 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 74.42 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.413 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.455 HD13 HD11 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 71.5 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 61.54 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 60.21 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.573 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 61.23 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.817 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 71.24 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.7 m120 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 70.21 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 51.55 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.598 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 54.02 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.817 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.534 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 3.7 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.533 HG22 HG23 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 70.42 111.779 177.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t -81.69 7.83 11.44 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 73.21 112.968 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.67 135.95 48.81 Favored Pre-proline 0 CA--C 1.559 1.306 0 C-N-CA 123.908 0.883 . . . . 71.51 111.47 -177.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -79.66 -0.88 11.06 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.646 2.231 . . . . 74.43 112.767 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.49 ' HB3' HG23 ' B' ' 55' ' ' VAL . 82.4 m-20 -157.25 136.0 11.54 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.975 1.31 . . . . 61.14 110.007 -171.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.49 ' H ' HD23 ' B' ' 54' ' ' LEU . 0.6 OUTLIER -89.93 19.19 5.02 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.475 0.71 . . . . 71.35 111.421 178.245 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 53' ' ' ASN . 84.5 t -56.64 -36.51 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 124.165 0.986 . . . . 75.11 111.014 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.437 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt -98.84 24.28 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 124.026 0.93 . . . . 64.42 112.7 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 63.2 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.504 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 72.25 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 50.24 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.578 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 64.31 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.533 HG23 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 71.32 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 54.2 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.598 HG21 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 64.02 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.455 HD11 HD13 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 60.31 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 31.24 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.475 ' H ' ' HB3' ' B' ' 6' ' ' ASN . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 60.23 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.464 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 73.04 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.469 HG23 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 54.22 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 73.2 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 61.32 110.673 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.617 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 62.3 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.512 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 71.22 110.331 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 73.25 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.617 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.21 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 71.13 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 52.22 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 72.55 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 65.4 112.03 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 54.4 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 15.41 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 73.23 111.611 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 72.23 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 64.31 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 42.12 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.512 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 72.11 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.505 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 71.32 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.532 HD12 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 65.34 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 64.34 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.532 ' HG3' HD12 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 51.55 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 54.41 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 74.52 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.441 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 72.04 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 60.3 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.457 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' THR . . . . . 0.441 HG22 ' O ' ' B' ' 117' ' ' GLN . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 73.43 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.457 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 65.32 110.151 176.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 53.42 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 62.14 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.532 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 42.42 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.629 ' HA ' HG22 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 70.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 72.22 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.566 HD13 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 71.32 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.629 HG22 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 62.33 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 72.41 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.546 ' HG2' ' H ' ' B' ' 141' ' ' ASP . 47.8 tttm -98.67 178.79 4.88 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 71.24 110.32 178.523 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 141' ' ' ASP . . . . . 0.546 ' H ' ' HG2' ' B' ' 140' ' ' LYS . 3.2 m-20 -43.43 -47.06 6.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 125.103 1.361 . . . . 51.42 111.586 167.777 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 142' ' ' ASP . . . . . 0.655 ' HB2' ' HD3' ' A' ' 140' ' ' LYS . 7.6 m-20 . . . . . 0 CA--C 1.557 1.216 0 C-N-CA 124.74 1.216 . . . . 72.2 110.978 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 CA-C-O 119.762 -0.465 . . . . 74.14 113.237 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m -60.82 102.59 0.2 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.985 0.914 . . . . 73.52 112.406 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -87.52 145.18 26.35 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.643 0.777 . . . . 72.41 111.376 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -94.82 -6.49 42.72 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.517 0.727 . . . . 63.31 112.821 -172.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -78.72 71.94 5.21 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.069 0.938 . . . . 54.42 110.187 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -100.7 114.74 28.74 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.13 0.972 . . . . 72.04 110.144 -176.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -86.83 86.36 7.32 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.222 1.01 . . . . 73.33 111.748 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -73.87 -12.68 60.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 115.851 -0.613 . . . . 74.54 111.675 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 64.43 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 63.21 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 74.31 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 72.25 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 72.43 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 61.45 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 51.5 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 63.34 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 73.13 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.405 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 73.41 110.644 -174.462 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.56 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.578 ' HB3' HD22 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' PRO . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 51.3 113.816 178.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 71.14 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 74.13 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 64.22 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.446 ' HG3' HD11 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 72.24 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 73.31 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.12 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 72.34 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 54.23 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 74.43 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 70.5 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 HG23 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t -77.89 -1.15 30.38 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 53.0 112.879 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.572 ' HA ' HD11 ' A' ' 56' ' ' ILE . 0.8 OUTLIER -46.84 113.77 2.49 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 125.437 1.495 . . . . 73.24 113.052 -178.974 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' HD11 ' A' ' 56' ' ' ILE . 59.6 Cg_endo -68.53 -21.4 40.03 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.599 2.199 . . . . 74.43 111.631 171.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -154.65 153.4 31.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.095 1.358 . . . . 71.45 108.269 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.421 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -72.55 2.32 6.59 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 112.74 0.645 . . . . 73.21 112.74 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.77 -33.5 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 C-N-CA 124.615 1.166 . . . . 63.23 112.049 172.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.572 HD11 ' HA ' ' A' ' 51' ' ' ASP . 42.0 pt -103.54 23.81 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 C-N-CA 123.402 0.681 . . . . 71.23 112.447 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 65.41 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 55.22 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 52.03 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 34.04 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.524 HG23 HG22 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 74.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.569 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 74.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.653 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 71.25 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 34.32 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.487 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 63.03 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 52.11 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.653 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.11 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.42 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.23 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.789 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.42 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' HD23 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 71.13 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.655 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 71.32 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.32 112.881 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.02 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 42.33 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 62.32 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.789 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 74.43 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.531 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.481 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 63.44 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.482 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 63.32 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.599 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 33.21 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.599 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 62.22 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.482 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.11 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.446 HD11 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 61.44 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 72.11 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.576 ' HG2' HD21 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 64.33 110.0 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 73.23 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 44.41 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 62.11 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.628 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.41 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 54.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 42.54 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.6 ' HB2' HD11 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 63.34 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 45.45 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' B' ' 140' ' ' LYS . 0.1 OUTLIER -77.54 -149.7 0.04 OUTLIER 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 140' ' ' LYS . 15.0 m-20 61.9 24.59 14.66 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.576 1.15 . . . . 62.43 110.338 -167.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.562 1.428 0 C-N-CA 125.095 1.358 . . . . 73.44 108.924 -170.989 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 CA-C-O 119.957 -0.357 . . . . 64.41 113.179 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -147.33 132.65 18.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.862 0.865 . . . . 74.14 110.676 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -89.73 161.04 16.26 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.686 0.794 . . . . 72.11 110.402 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -133.71 -48.91 0.82 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 122.998 0.519 . . . . 75.11 111.865 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.21 84.53 2.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.503 0.721 . . . . 72.3 112.358 -175.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -97.94 -161.1 0.85 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.798 0.839 . . . . 64.42 109.468 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.71 42.61 0.92 Allowed 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.464 0.706 . . . . 63.54 112.117 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.523 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 73.23 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' SER . . . . . 0.439 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 65.25 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.523 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 61.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 50.45 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.585 HD23 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.61 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.46 HG11 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 51.11 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.401 ' HA ' ' CE1' ' B' ' 87' ' ' TYR . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.509 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 71.51 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.53 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 60.45 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.597 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 74.42 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.446 ' HB2' HD13 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 71.5 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 61.54 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' HD11 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 60.21 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 61.23 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.567 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 71.24 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 70.21 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 51.55 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.729 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 54.02 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.626 ' HB3' HD21 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.63 HG22 HG23 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 70.42 111.522 173.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t -99.59 9.19 43.61 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 73.21 111.829 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.649 ' HB3' HD11 ' B' ' 56' ' ' ILE . 7.3 m-20 -67.24 161.41 64.28 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.122 0.969 . . . . 71.51 112.679 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.22 -33.78 66.48 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 122.867 2.378 . . . . 74.43 114.014 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -155.39 163.87 39.49 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.652 0.781 . . . . 61.14 110.144 -174.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 57' ' ' ARG . 2.5 pt? -84.24 -1.71 55.69 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.907 0.483 . . . . 71.35 111.992 170.049 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -58.77 -30.01 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.856 0.862 . . . . 75.11 111.666 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.649 HD11 ' HB3' ' B' ' 51' ' ' ASP . 18.8 pt -93.11 26.55 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 124.604 1.162 . . . . 64.42 112.61 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.614 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 63.2 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.451 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 72.25 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 50.24 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.614 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.61 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 64.31 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.63 HG23 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 71.32 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 54.2 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.729 HG21 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 64.02 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 60.31 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.641 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 31.24 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.641 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 60.23 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 73.04 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 54.22 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 73.2 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 61.32 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 62.3 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.502 HD21 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 71.22 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 73.25 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.21 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.434 ' HG3' HD22 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 71.13 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.585 HD12 HD23 ' B' ' 21' ' ' LEU . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 52.22 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 72.55 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 65.4 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 54.4 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 15.41 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 73.23 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 72.23 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 64.31 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 42.12 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 72.11 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 107' ' ' ILE . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 71.32 113.062 177.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.402 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.41 ' O ' HD13 ' B' ' 106' ' ' ILE . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 65.34 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 64.34 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 51.55 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 54.41 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 74.52 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 72.04 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 60.3 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.674 ' SD ' HD21 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 121' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.502 ' HG2' HD21 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 73.43 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.521 HG22 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 65.32 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 53.42 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 62.14 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 42.42 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 70.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 72.22 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 71.32 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.496 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 62.33 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 72.41 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.441 ' HD3' ' HG3' ' A' ' 140' ' ' LYS . 9.6 mtpm? -104.6 -51.64 3.04 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 71.24 111.073 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 81.15 -47.8 0.25 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 126.369 1.868 . . . . 51.42 111.718 -173.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 CA--C 1.571 1.752 0 C-N-CA 123.045 0.538 . . . . 72.2 112.121 -178.417 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.475 -0.25 . . . . 74.14 112.475 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.9 p -122.15 106.65 11.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 117.53 0.665 . . . . 73.52 110.752 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -102.38 154.94 18.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.71 0.804 . . . . 72.41 111.889 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -73.4 -17.71 61.23 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.362 0.875 . . . . 63.31 113.362 -174.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -60.81 149.67 35.15 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.742 0.817 . . . . 54.42 112.531 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -92.88 39.28 1.04 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 123.973 0.909 . . . . 72.04 110.747 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -72.1 133.91 45.48 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 121.617 0.722 . . . . 73.33 112.834 -173.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.439 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 -81.0 -22.84 39.12 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.632 0.773 . . . . 74.54 112.853 -172.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 64.43 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 63.21 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 74.31 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 72.25 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 72.43 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 61.45 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 51.5 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 63.34 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.597 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 73.13 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 73.41 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD3' HG22 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.7 HD11 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.62 HG22 HD11 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 51.3 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 71.14 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 74.13 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 64.22 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 25.0 mm-40 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 72.24 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 73.31 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG22 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.12 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 72.34 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 54.23 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.603 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 74.43 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 70.5 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.508 ' OE1' HG13 ' A' ' 48' ' ' VAL . 0.0 OUTLIER -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.667 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -97.65 0.6 47.48 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 53.0 111.974 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -107.51 132.89 20.65 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.907 0.883 . . . . 73.24 111.455 -171.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -82.38 11.23 3.25 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 123.119 2.546 . . . . 74.43 113.811 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.594 ' HB3' HG23 ' A' ' 55' ' ' VAL . 18.3 m120 -144.15 139.84 29.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.408 0.683 . . . . 71.45 110.744 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.471 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -80.19 1.16 29.37 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 123.626 0.77 . . . . 73.21 112.18 167.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.594 HG23 ' HB3' ' A' ' 53' ' ' ASN . 77.1 t -55.95 -43.32 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.514 0.726 . . . . 63.23 112.21 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt -93.82 23.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 C-N-CA 123.74 0.816 . . . . 71.23 112.958 -178.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 65.41 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 55.22 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 52.03 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 34.04 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.7 HD21 HD11 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 74.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 74.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.43 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 71.25 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 75' ' ' GLY . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 34.32 111.107 173.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.439 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.463 ' H ' HG23 ' A' ' 71' ' ' THR . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.482 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 63.03 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 52.11 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.11 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.23 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 71.13 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.546 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 71.32 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.32 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.571 HG23 HG23 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.02 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.571 HG23 HG23 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 42.33 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.546 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.628 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 62.32 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 74.43 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.431 ' O ' HD13 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 63.44 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.4 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 63.32 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.694 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 33.21 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.694 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 62.22 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.11 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 61.44 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 72.11 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 64.33 110.108 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 73.23 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 44.41 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 62.11 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.41 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 54.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.646 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 42.54 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.722 ' HB2' HD11 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 63.34 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 45.45 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm -85.86 158.41 19.96 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -66.29 -42.45 88.38 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 124.35 1.06 . . . . 62.43 112.122 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 CA--C 1.563 1.46 0 C-N-CA 123.471 0.708 . . . . 73.44 110.734 172.35 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 CA-C-O 120.085 -0.286 . . . . 64.41 112.701 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -152.98 164.99 36.94 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.786 0.835 . . . . 74.14 110.804 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -155.43 150.06 26.27 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.025 0.93 . . . . 72.11 111.142 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -86.7 -29.11 22.68 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.388 0.885 . . . . 75.11 113.388 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.76 152.37 41.64 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 118.115 0.416 . . . . 72.3 110.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -69.43 -93.02 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 CA-C-O 118.451 -0.785 . . . . 64.42 111.348 -176.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 61.99 148.08 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 173.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 73.23 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.598 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 65.25 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.598 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 61.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 50.45 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.406 ' HB ' HD12 ' B' ' 25' ' ' ILE . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 51.11 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.652 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 71.51 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.822 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 60.45 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 74.42 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 71.5 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 61.54 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 60.21 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 61.23 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 71.24 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 70.21 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 51.55 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.498 ' O ' HG22 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 54.02 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.56 ' HB3' HD21 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 70.42 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t -80.7 -0.43 38.31 Favored 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 73.21 112.643 -176.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.452 ' HB2' HD11 ' B' ' 56' ' ' ILE . 2.6 p-10 -80.58 144.72 57.27 Favored Pre-proline 0 CA--C 1.558 1.261 0 C-N-CA 123.733 0.813 . . . . 71.51 111.344 -175.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -80.24 -6.77 13.95 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.902 2.401 . . . . 74.43 113.951 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -147.13 135.35 21.61 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.312 0.645 . . . . 61.14 109.848 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.559 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.0 pt? -78.38 1.54 21.65 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.972 0.509 . . . . 71.35 111.517 172.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 38.9 t -65.72 -41.28 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.236 1.014 . . . . 75.11 110.953 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.452 HD11 ' HB2' ' B' ' 51' ' ' ASP . 37.9 pt -84.96 17.57 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 CA-C-N 115.73 -0.668 . . . . 64.42 112.634 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.542 ' O ' HG23 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 63.2 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 72.25 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 50.24 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' B' ' 48' ' ' VAL . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.822 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 64.31 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.429 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' B' ' 67' ' ' ILE . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 71.32 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 54.2 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 64.02 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 60.31 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.509 HG21 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 31.24 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 60.23 111.524 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 73.04 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 54.22 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 73.2 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' PHE . . . . . 0.473 ' O ' HD13 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 61.32 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.652 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 62.3 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.532 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 71.22 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' TYR . . . . . 0.434 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 73.25 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.485 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.21 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 71.13 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 52.22 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.601 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 72.55 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HD3' HD13 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 65.4 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.438 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 54.4 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 15.41 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 73.23 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 72.23 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.601 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 64.31 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 42.12 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 72.11 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.491 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 71.32 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.555 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 65.34 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 64.34 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 51.55 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 54.41 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.555 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 74.52 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 72.04 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 60.3 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 73.43 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.436 ' HE2' ' HB2' ' B' ' 124' ' ' MET . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 65.32 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 53.42 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 62.14 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 42.42 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.534 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 70.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 72.22 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 71.32 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.534 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 62.33 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.632 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.722 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 72.41 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm -81.08 164.05 22.72 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 71.24 112.524 -170.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -65.35 -7.15 12.22 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.599 1.16 . . . . 51.42 113.761 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.568 1.65 0 C-N-CA 123.785 0.834 . . . . 72.2 112.034 178.773 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.035 0 CA-C-O 120.332 -0.149 . . . . 74.14 112.943 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -78.35 176.78 9.01 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.246 0.618 . . . . 73.52 111.066 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.87 119.93 8.1 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.829 0.852 . . . . 72.41 113.028 -172.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -95.88 -49.72 5.19 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.242 1.017 . . . . 63.31 111.271 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -70.98 124.98 25.61 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.034 0.534 . . . . 54.42 111.995 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -124.44 97.08 5.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.696 1.198 . . . . 72.04 111.006 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 31.3 t70 -81.31 75.54 8.27 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.545 1.165 . . . . 73.33 111.056 177.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -80.36 -13.49 59.12 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.032 -0.986 . . . . 74.54 111.01 170.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 64.43 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.419 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 63.21 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 74.31 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 72.25 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 72.43 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 61.45 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 51.5 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 63.34 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.595 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 73.13 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.402 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 73.41 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.742 ' HA ' HG12 ' A' ' 30' ' ' ILE . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.656 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 51.3 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.417 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 71.14 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.429 HD13 HD11 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 74.13 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 64.22 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 72.24 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 73.31 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.551 HG12 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.656 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.12 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 72.34 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 54.23 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 74.43 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 70.5 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p -60.62 -25.41 66.25 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 53.0 110.487 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -114.11 107.32 52.11 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.331 1.052 . . . . 73.24 108.949 163.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.5 -36.9 14.1 Favored 'Trans proline' 0 CA--C 1.565 2.042 0 C-N-CA 122.066 1.844 . . . . 74.43 113.049 171.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -93.24 -161.37 0.84 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 123.71 0.804 . . . . 71.45 112.908 -173.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.595 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -88.66 13.57 11.98 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.477 1.111 . . . . 73.21 113.42 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.9 t -60.77 -57.15 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 112.463 0.542 . . . . 63.23 112.463 -167.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -116.81 27.42 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.445 0.698 . . . . 71.23 112.569 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.537 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 65.41 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.702 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 55.22 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.735 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 52.03 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 34.04 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.429 HD11 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 74.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 74.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.43 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 71.25 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 34.32 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.551 ' HG2' HG12 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 63.03 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 52.11 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.11 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . 0.404 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.23 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.404 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.538 ' HB3' HD23 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 71.13 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 71.32 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.49 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.32 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.02 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 42.33 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 62.32 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 74.43 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.444 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 63.44 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 63.32 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 33.21 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 62.22 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.476 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.11 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 61.44 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 72.11 111.831 178.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 64.33 110.24 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 73.23 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 44.41 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.446 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 62.11 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.3 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.41 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 54.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 42.54 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.614 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 63.34 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.556 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 45.45 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -103.13 154.25 19.49 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.09 -32.71 74.33 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.281 0.632 . . . . 62.43 112.292 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.568 1.668 0 C-N-CA 123.861 0.864 . . . . 73.44 110.996 -178.221 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 120.672 0.04 . . . . 64.41 113.185 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -83.77 -42.6 16.34 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.244 0.618 . . . . 74.14 112.096 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.01 116.05 9.93 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.164 0.586 . . . . 72.11 111.288 -176.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -81.11 -24.16 37.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.25 0.62 . . . . 75.11 110.531 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -70.38 89.04 0.67 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.42 0.688 . . . . 72.3 111.193 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -87.05 93.24 9.31 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.886 0.851 . . . . 64.42 109.216 170.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -88.2 38.59 0.86 Allowed 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 -173.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 73.23 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 65.25 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 61.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 50.45 111.104 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.625 HD23 HD12 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.441 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.771 HG11 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 51.11 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 71.51 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 60.45 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.478 ' HA ' HD12 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 74.42 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 71.5 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 61.54 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.43 ' HG3' HD21 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 60.21 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.617 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 61.23 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.438 HD12 HD21 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 71.24 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 70.21 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 51.55 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 47' ' ' GLN . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 54.02 111.912 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 44' ' ' ASP . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 70.42 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -96.85 -22.04 17.14 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 73.21 109.525 168.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.421 ' HB2' HD11 ' B' ' 56' ' ' ILE . 23.7 t70 -53.4 140.47 45.55 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 126.101 1.76 . . . . 71.51 111.852 168.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' B' ' 51' ' ' ASP . 2.8 Cg_endo -39.82 -70.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 123.668 2.912 . . . . 74.43 113.309 169.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -135.0 -87.18 0.38 Allowed 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 118.735 0.698 . . . . 61.14 112.839 175.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 pp -126.77 38.03 4.18 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.298 0.851 . . . . 71.35 113.298 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 13.3 t -86.57 -57.7 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.711 0.805 . . . . 75.11 112.682 -169.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.542 HD12 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp -98.3 31.48 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 64.42 113.61 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 63.2 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 72.25 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 50.24 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.562 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.492 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 64.31 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 71.32 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 54.2 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 64.02 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.446 HD21 HD13 ' B' ' 34' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 60.31 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 31.24 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 60.23 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 73.04 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 54.22 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 73.2 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 61.32 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 62.3 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 71.22 110.463 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 73.25 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 88' ' ' PRO . . . . . 0.466 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.21 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.558 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 71.13 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.771 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 52.22 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.511 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 72.55 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 65.4 112.842 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 54.4 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 15.41 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 73.23 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 72.23 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.511 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 64.31 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 42.12 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.425 ' HD2' ' HB2' ' B' ' 99' ' ' PRO . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 72.11 110.858 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 71.32 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.444 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 65.34 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 64.34 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 51.55 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 54.41 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 74.52 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 117' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 72.04 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.43 HD21 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 60.3 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.518 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 73.43 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.518 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 65.32 110.736 -176.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 53.42 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 62.14 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 42.42 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.627 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.3 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 70.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 72.22 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 71.32 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.627 HG22 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 62.33 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 72.41 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? -105.04 -167.12 1.3 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 71.24 111.46 -174.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -123.87 21.25 9.13 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.249 0.619 . . . . 51.42 112.217 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 . . . . . 0 N--CA 1.492 1.641 0 C-N-CA 123.362 0.665 . . . . 72.2 112.125 -176.437 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.901 0 CA-C-O 120.476 -0.069 . . . . 74.14 112.974 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.2 t -154.79 31.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.669 0.747 . . . . 73.52 110.663 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -152.71 -78.44 0.11 Allowed 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 115.461 -0.79 . . . . 72.41 112.311 -170.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -110.0 -61.56 1.64 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.648 -0.657 . . . . 63.31 112.491 -172.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -88.29 171.14 10.4 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 112.486 0.55 . . . . 54.42 112.486 -175.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -95.21 153.08 17.83 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 123.716 0.806 . . . . 72.04 111.181 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -121.23 111.53 17.51 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.548 0.739 . . . . 73.33 111.287 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -81.28 -38.87 26.14 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.064 0.945 . . . . 74.54 112.6 -175.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 64.43 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 63.21 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 74.31 111.022 172.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 72.25 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 72.43 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 61.45 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 51.5 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 25' ' ' ILE . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 63.34 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.553 HG11 HD21 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 73.13 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 73.41 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.466 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.743 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.466 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 51.3 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 71.14 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.471 HD13 HD11 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 74.13 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 64.22 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HG3' HD11 ' A' ' 118' ' ' LEU . 26.8 mm-40 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 72.24 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 73.31 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.12 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 72.34 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 54.23 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 74.43 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 70.5 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t -90.03 -8.26 51.97 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 53.0 112.798 -175.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.402 ' HB2' HD11 ' A' ' 56' ' ' ILE . 5.2 p-10 -78.62 145.67 67.67 Favored Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 123.761 0.824 . . . . 73.24 112.406 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.21 -2.09 9.37 Favored 'Trans proline' 0 CA--C 1.565 2.033 0 C-N-CA 123.14 2.56 . . . . 74.43 114.683 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.512 ' HB3' HG23 ' A' ' 55' ' ' VAL . 17.9 m120 -151.67 141.86 22.3 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-N 118.734 0.697 . . . . 71.45 110.964 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 2.7 pt? -74.76 -0.9 19.73 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.624 0.77 . . . . 73.21 112.637 173.359 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.512 HG23 ' HB3' ' A' ' 53' ' ' ASN . 42.4 t -63.46 -32.01 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.82 0.848 . . . . 63.23 112.012 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.453 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp -98.63 28.85 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.395 1.078 . . . . 71.23 113.556 -173.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 65.41 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 55.22 111.433 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.743 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 52.03 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 34.04 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 74.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 74.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.43 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 71.25 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 34.32 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 63.03 112.706 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.436 ' HA ' HD12 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 52.11 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.495 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.11 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.23 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 71.13 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 71.32 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.32 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 90' ' ' LEU . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.02 112.618 175.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 42.33 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 98' ' ' GLU . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 62.32 109.869 162.316 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 74.43 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.495 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 63.44 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 63.32 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.406 HG23 ' HG3' ' A' ' 112' ' ' GLU . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 33.21 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.406 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 62.22 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.11 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.569 HD11 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 61.44 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 72.11 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 64.33 110.552 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 73.23 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 44.41 110.931 173.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 62.11 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.555 ' HA ' HG22 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.41 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 54.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 42.54 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 63.34 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 45.45 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -86.55 150.31 24.33 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 63.28 15.28 8.51 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.867 1.267 . . . . 62.43 111.941 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 124.214 1.006 . . . . 73.44 111.819 -176.696 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 112.838 -0.105 . . . . 64.41 112.838 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 30.5 t -83.11 73.82 10.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.576 0.703 . . . . 74.14 109.427 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -124.33 140.28 53.1 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.087 0.955 . . . . 72.11 110.426 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.49 -44.19 12.92 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.127 -0.694 . . . . 75.11 109.127 170.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.98 128.49 44.58 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.156 0.982 . . . . 72.3 110.344 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -78.23 105.41 9.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.843 0.457 . . . . 64.42 110.616 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.57 130.86 35.38 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 73.23 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 65.25 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.473 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 61.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 50.45 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.61 HD23 HD12 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.447 HG11 HD21 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 51.11 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.508 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 71.51 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.582 ' HB3' HD22 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 60.45 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 74.42 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 71.5 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 61.54 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 60.21 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 61.23 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 71.24 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 70.21 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 51.55 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 54.02 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 70.42 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -79.78 1.21 27.6 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 73.21 111.769 170.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.672 ' HB3' ' HE3' ' B' ' 60' ' ' LYS . 6.8 p-10 -72.89 128.29 88.29 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 122.605 0.362 . . . . 71.51 111.606 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -80.92 5.73 6.01 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 C-N-CA 122.669 2.246 . . . . 74.43 112.768 167.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.492 ' HB2' HG23 ' B' ' 55' ' ' VAL . 0.3 OUTLIER -165.43 144.86 6.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.689 0.796 . . . . 61.14 111.89 -175.835 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.549 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.3 pt? -80.0 1.73 26.44 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.92 0.488 . . . . 71.35 112.096 176.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.492 HG23 ' HB2' ' B' ' 53' ' ' ASN . 39.4 t -58.92 -35.12 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.869 0.867 . . . . 75.11 111.615 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.403 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.2 pp -109.93 24.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.835 0.854 . . . . 64.42 112.352 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 63.2 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 72.25 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 50.24 111.94 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.672 ' HE3' ' HB3' ' B' ' 51' ' ' ASP . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 64.31 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 71.32 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 54.2 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 64.02 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 60.31 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 31.24 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 60.23 111.448 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.455 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 73.04 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.479 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 54.22 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 73.2 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 61.32 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 62.3 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 71.22 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 73.25 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.41 ' HB3' HD23 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.21 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 71.13 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.61 HD12 HD23 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 52.22 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 72.55 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.585 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 65.4 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 54.4 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 15.41 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 73.23 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 72.23 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.406 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 64.31 113.251 170.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 42.12 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 72.11 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.469 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 71.32 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 105' ' ' MET . . . . . 0.479 ' HG2' HG12 ' B' ' 77' ' ' VAL . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 65.34 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 64.34 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' B' ' 36' ' ' GLN . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.404 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 51.55 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 54.41 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 74.52 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 72.04 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 60.3 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.481 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 73.43 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.481 HG22 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.4 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 65.32 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 53.42 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 62.14 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 42.42 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.6 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 70.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 72.22 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 71.32 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 62.33 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 72.41 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -114.97 -45.99 2.94 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 71.24 111.565 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.32 -55.61 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.441 -1.254 . . . . 51.42 110.624 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 CA--C 1.565 1.525 0 C-N-CA 123.38 0.672 . . . . 72.2 110.303 178.423 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.042 0 CA-C-O 119.751 -0.472 . . . . 74.14 112.492 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -90.07 131.78 35.76 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 117.562 0.681 . . . . 73.52 110.672 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -76.22 108.72 9.34 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.533 0.683 . . . . 72.41 111.045 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.35 -67.12 0.77 Allowed 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 115.627 -0.715 . . . . 63.31 109.206 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -125.59 -44.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 107.766 -1.198 . . . . 54.42 107.766 165.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -51.97 124.35 12.57 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.787 1.235 . . . . 72.04 111.419 171.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -127.62 29.69 5.45 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 111.803 0.298 . . . . 73.33 111.803 -168.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.09 -50.38 69.31 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.294 1.037 . . . . 74.54 113.655 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 64.43 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 63.21 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 74.31 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 72.25 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 72.43 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 61.45 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 51.5 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.473 HD23 HD12 ' A' ' 90' ' ' LEU . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 63.34 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.711 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.657 HG11 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 73.13 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 73.41 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 51.3 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 71.14 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 74.13 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 64.22 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 110' ' ' SER . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 72.24 112.002 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 73.31 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.12 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 72.34 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 54.23 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.402 ' O ' HG22 ' A' ' 48' ' ' VAL . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 74.43 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.437 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 70.5 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.676 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.494 HD21 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -84.52 -4.2 58.82 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 53.0 110.885 171.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -48.96 130.29 14.99 Favored Pre-proline 0 CA--C 1.568 1.637 0 C-N-CA 124.609 1.163 . . . . 73.24 113.378 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.702 ' HD2' HD11 ' A' ' 56' ' ' ILE . 85.3 Cg_endo -75.47 -7.98 19.16 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 122.801 2.334 . . . . 74.43 113.11 174.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -174.17 164.77 4.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.366 1.066 . . . . 71.45 110.532 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -66.04 -14.41 61.66 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.58 0.956 . . . . 73.21 113.58 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.59 -57.31 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.801 0.841 . . . . 63.23 111.968 -171.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.702 HD11 ' HD2' ' A' ' 52' ' ' PRO . 2.6 pp -79.51 3.53 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 71.23 113.108 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.711 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 65.41 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 55.22 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 34.04 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 74.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 74.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.581 HD13 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.43 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 71.25 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 34.32 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 63.03 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 52.11 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HB2' HD13 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.11 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.23 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 71.13 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.447 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.54 ' HG3' HD22 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.657 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.564 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.586 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 71.32 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.484 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.32 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.44 HG22 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.02 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 42.33 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.586 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 62.32 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.416 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 74.43 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 63.44 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 63.32 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 103' ' ' PHE . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 33.21 112.614 -176.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.51 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 62.22 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.477 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.11 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 61.44 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.493 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 72.11 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 64.33 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 73.23 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 44.41 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 62.11 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.617 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.41 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 54.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.617 HG22 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 42.54 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 63.34 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.603 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 45.45 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm -77.14 157.01 31.23 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 72.25 0.98 3.78 Favored 'General case' 0 CA--C 1.566 1.593 0 C-N-CA 125.388 1.475 . . . . 62.43 111.967 -174.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 73.44 110.413 -179.939 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 CA-C-O 120.056 -0.302 . . . . 64.41 112.69 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -140.19 120.28 13.72 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.243 0.545 . . . . 74.14 111.143 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -97.6 116.98 30.86 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.678 1.191 . . . . 72.11 110.225 173.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -88.56 -29.56 19.95 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 113.663 0.986 . . . . 75.11 113.663 -169.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.85 154.38 30.2 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.721 0.409 . . . . 72.3 111.181 176.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -65.94 105.22 1.27 Allowed 'General case' 0 N--CA 1.484 1.27 0 CA-C-O 120.906 0.384 . . . . 64.42 110.581 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -96.76 89.95 5.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.559 0.744 . . . . 63.54 112.764 -169.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.405 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 73.23 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.406 HD23 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 65.25 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.411 ' O ' HG23 ' B' ' 22' ' ' THR . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 61.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 50.45 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.51 HD23 HD12 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.488 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.78 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.451 HG11 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 51.11 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 71.51 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.586 ' HD3' HG22 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.512 ' HB2' HD11 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 60.45 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.55 HG23 ' O ' ' B' ' 27' ' ' PRO . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 74.42 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 71.5 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 61.54 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 34.4 mm-40 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 60.21 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 61.23 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 74' ' ' LYS . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 71.24 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 70.21 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 51.55 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.514 ' O ' HG22 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 54.02 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.612 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 70.42 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t -81.21 0.99 34.15 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 73.21 112.372 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -81.6 142.56 49.77 Favored Pre-proline 0 CA--C 1.562 1.424 0 C-N-CA 123.415 0.686 . . . . 71.51 110.8 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -87.35 5.45 5.63 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.245 2.63 . . . . 74.43 113.432 177.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -172.43 159.57 4.62 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.956 0.902 . . . . 61.14 111.254 -171.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.07 25.45 0.29 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.845 1.054 . . . . 71.35 113.845 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 96.0 t -76.46 -55.45 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.712 -0.618 . . . . 75.11 111.231 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt -95.7 10.14 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 64.42 113.518 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.491 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 63.2 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 72.25 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 50.24 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.612 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.586 HG22 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 64.31 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 71.32 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 54.2 110.339 174.45 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 64.02 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 60.31 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 31.24 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.401 ' HB3' HG12 ' B' ' 39' ' ' VAL . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 60.23 111.101 174.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 73.04 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.501 ' HA ' HD12 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 54.22 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' B' ' 105' ' ' MET . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 73.2 112.639 177.055 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 61.32 109.3 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 62.3 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 71.22 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 73.25 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.447 ' HB3' HD23 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.21 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.458 ' HG3' HD22 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 71.13 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.58 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 52.22 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 72.55 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 65.4 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.507 HG23 HG23 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 54.4 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.507 HG23 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 15.41 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 73.23 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 72.23 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 64.31 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 42.12 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 72.11 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 71.32 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 105' ' ' MET . . . . . 0.401 ' HG2' ' HB2' ' B' ' 78' ' ' ALA . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.537 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 65.34 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 64.34 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.537 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 51.55 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 54.41 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 74.52 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 72.04 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 60.3 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.4 ' O ' HG13 ' B' ' 123' ' ' VAL . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 73.43 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 119' ' ' LEU . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 65.32 110.958 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 53.42 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 62.14 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' B' ' 126' ' ' LEU . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 42.42 111.314 173.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 126' ' ' LEU . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 70.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 72.22 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 71.32 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 62.33 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.603 ' HB2' HD11 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 72.41 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -97.39 -81.59 0.43 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 71.24 111.538 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.27 17.17 22.51 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.027 0.931 . . . . 51.42 111.054 -175.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.568 0.747 . . . . 72.2 111.22 -179.788 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 CA-C-O 120.23 -0.205 . . . . 74.14 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 t 59.71 -148.39 0.46 Allowed 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.267 1.027 . . . . 73.52 110.972 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.04 157.52 38.07 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.499 0.59 . . . . 72.41 110.675 171.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.35 -10.02 59.26 Favored 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 114.135 1.161 . . . . 63.31 114.135 -170.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.93 102.03 0.56 Allowed 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.673 0.669 . . . . 54.42 111.898 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -158.65 103.14 1.73 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 107.758 -1.201 . . . . 72.04 107.758 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -64.11 130.66 44.84 Favored 'General case' 0 CA--C 1.557 1.22 0 N-CA-C 113.303 0.853 . . . . 73.33 113.303 -162.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.6 -34.93 30.67 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.562 1.145 . . . . 74.54 111.638 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 64.43 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 63.21 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 74.31 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 72.25 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.408 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 72.43 112.893 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.535 ' HG2' HD13 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 61.45 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 51.5 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.482 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 63.34 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.566 HG11 HD21 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 73.13 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 73.41 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.732 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.565 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.554 HG22 HD11 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 51.3 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 71.14 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.486 HD13 HD21 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 74.13 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 64.22 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HG3' HD11 ' A' ' 118' ' ' LEU . 28.8 mm-40 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 72.24 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.544 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 73.31 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.51 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.554 HD11 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.12 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 72.34 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 54.23 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 74.43 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 70.5 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -120.03 -30.79 4.61 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 53.0 111.049 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -92.14 134.14 29.05 Favored Pre-proline 0 CA--C 1.569 1.691 0 C-N-CA 123.605 0.762 . . . . 73.24 111.441 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -91.68 40.01 0.31 Allowed 'Trans proline' 0 CA--C 1.563 1.953 0 C-N-CA 123.49 2.793 . . . . 74.43 113.811 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 55' ' ' VAL . 85.2 m-20 -152.37 163.95 38.47 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 123.213 0.605 . . . . 71.45 111.653 -167.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -104.06 25.65 9.72 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.611 0.597 . . . . 73.21 112.611 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 53' ' ' ASN . 75.9 t -70.33 -56.81 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.358 0.663 . . . . 63.23 111.521 -179.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -98.71 23.73 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 123.867 0.867 . . . . 71.23 111.751 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.732 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 65.41 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 55.22 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.565 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 52.03 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 34.04 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.449 HD11 HD12 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.535 HD13 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 74.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 74.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.486 HD21 HD13 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.43 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 71.25 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 34.32 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.51 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 63.03 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.498 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 52.11 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.11 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.497 HD23 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.23 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.584 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.418 ' HB3' HD23 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 71.13 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.621 HD13 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 71.32 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.621 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.32 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.02 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.406 HG23 HG23 ' A' ' 94' ' ' VAL . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 42.33 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 62.32 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.584 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 74.43 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 63.44 111.233 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 63.32 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.544 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 33.21 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 62.22 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.11 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 61.44 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 72.11 113.039 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 64.33 110.63 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 67.1 tp60 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 73.23 111.321 176.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 44.41 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 62.11 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.41 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 54.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.494 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 42.54 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.592 ' HB2' HD11 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 63.34 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 45.45 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.409 ' HD2' HD23 ' B' ' 137' ' ' LEU . 63.9 tttm -99.96 -70.95 0.72 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -98.62 -30.28 12.57 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.058 -0.974 . . . . 62.43 110.727 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 CA--C 1.563 1.466 0 C-N-CA 123.422 0.689 . . . . 73.44 110.269 173.342 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.048 0 N-CA-C 112.975 -0.05 . . . . 64.41 112.975 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' SER . . . . . 0.691 ' HB2' ' HB2' ' B' ' 5' ' ' GLU . 66.2 m -89.86 154.19 20.07 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.695 0.798 . . . . 74.14 111.706 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.97 -61.25 2.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.588 1.155 . . . . 72.11 112.339 -172.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -82.87 -26.53 31.49 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.388 0.675 . . . . 75.11 111.617 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' GLU . . . . . 0.691 ' HB2' ' HB2' ' B' ' 2' ' ' SER . 41.3 mt-10 -78.56 76.27 5.07 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.589 0.709 . . . . 72.3 111.416 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -137.27 106.16 5.94 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.353 1.461 . . . . 64.42 107.946 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -65.81 123.69 20.45 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 -167.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' TRP . . . . . 0.466 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 73.23 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 65.25 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 61.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 50.45 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.573 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.405 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.577 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.676 HG11 HD21 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 51.11 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 HD11 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 71.51 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.664 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.502 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 60.45 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 74.42 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' B' ' 40' ' ' LEU . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 71.5 112.113 176.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 61.54 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 60.21 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 61.23 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.515 HD11 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 71.24 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 70.21 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 51.55 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 54.02 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 70.42 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.61 -34.33 75.47 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 73.21 111.064 173.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -124.76 81.14 61.57 Favored Pre-proline 0 CA--C 1.565 1.543 0 C-N-CA 124.721 1.208 . . . . 71.51 110.153 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.91 -5.78 12.81 Favored 'Trans proline' 0 N--CA 1.511 2.54 0 C-N-CA 123.657 2.905 . . . . 74.43 115.484 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -63.53 149.11 47.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.432 1.093 . . . . 61.14 112.896 -172.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.573 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.2 pt? -91.39 7.28 41.85 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 112.521 0.563 . . . . 71.35 112.521 177.189 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.53 -48.16 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 122.257 1.027 . . . . 75.11 110.169 172.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp -110.22 24.69 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 CA-C-N 113.483 -1.689 . . . . 64.42 111.175 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 63.2 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.577 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 72.25 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 50.24 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.58 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.664 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 64.31 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.472 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 71.32 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.466 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 54.2 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 64.02 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.436 HD21 HD12 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 60.31 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.593 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 31.24 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.593 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 60.23 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 73.04 111.565 173.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 54.22 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 73.2 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 61.32 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.5 HD11 HD13 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 62.3 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 71.22 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 73.25 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD23 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.21 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 71.13 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.676 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 52.22 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.444 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 72.55 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 65.4 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.456 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 54.4 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 15.41 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 73.23 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.506 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 72.23 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 64.31 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 42.12 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 72.11 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.659 ' HD2' HD21 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 71.32 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.461 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.601 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 65.34 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 64.34 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' GLU . . . . . 0.601 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 51.55 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 54.41 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.659 HD21 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 74.52 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 72.04 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 60.3 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.57 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 73.43 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.523 HG22 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 65.32 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 53.42 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 55.0 tp60 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 62.14 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 42.42 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.715 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 70.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 72.22 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 71.32 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.715 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 62.33 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.545 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 72.41 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -61.52 158.95 13.86 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 71.24 112.892 171.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 65.78 8.41 5.24 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.921 1.289 . . . . 51.42 112.783 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.426 0 C-N-CA 124.136 0.974 . . . . 72.2 110.118 -178.435 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 CA-C-O 120.45 -0.083 . . . . 74.14 113.13 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.2 m -88.23 123.2 32.61 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.236 0.615 . . . . 73.52 111.469 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -105.44 -159.89 0.73 Allowed 'General case' 0 CA--C 1.564 1.489 0 C-N-CA 123.773 0.829 . . . . 72.41 110.676 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -132.83 -43.27 0.9 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.819 0.848 . . . . 63.31 111.732 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.78 128.4 36.28 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.428 0.899 . . . . 54.42 113.428 -167.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -79.42 87.52 5.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.514 0.673 . . . . 72.04 109.283 168.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.44 113.93 6.42 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 115.261 -0.881 . . . . 73.33 113.212 -169.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.67 -19.37 41.79 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 64.43 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 63.21 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 74.31 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 72.25 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 72.43 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 61.45 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.47 HG21 ' NZ ' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 51.5 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 63.34 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.759 HG11 HD21 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 73.13 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.556 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 73.41 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.737 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HG3' HG23 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.606 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.602 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 51.3 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 71.14 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 74.13 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 64.22 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HB2' HD11 ' A' ' 118' ' ' LEU . 32.6 mm-40 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 72.24 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 73.31 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.12 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 72.34 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 54.23 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HB2' HG21 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 74.43 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 70.5 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.78 -34.81 75.06 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 53.0 111.281 172.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.404 ' HB2' HD11 ' A' ' 56' ' ' ILE . 3.3 p-10 -119.96 87.64 38.96 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.239 1.016 . . . . 73.24 110.44 173.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.62 -9.74 26.42 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.945 2.43 . . . . 74.43 115.02 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -70.3 146.47 50.55 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.172 0.804 . . . . 71.45 113.172 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.443 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -76.02 -12.74 60.19 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.481 1.113 . . . . 73.21 112.076 176.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.0 t -60.49 -36.46 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.783 0.833 . . . . 63.23 111.067 -175.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.404 HD11 ' HB2' ' A' ' 51' ' ' ASP . 6.3 pt -116.88 26.61 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.51 1.124 . . . . 71.23 111.625 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 65.41 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.562 ' HG3' HG13 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 55.22 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.658 HG22 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 52.03 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 34.04 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 74.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.459 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 74.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.43 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 71.25 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 34.32 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.533 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 63.03 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 52.11 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.509 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.524 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.11 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.23 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 71.13 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.49 ' HG3' HD22 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.427 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 71.32 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.47 ' NZ ' HG21 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.32 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.02 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 42.33 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.595 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 62.32 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 74.43 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' A' ' 107' ' ' ILE . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.509 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 63.44 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.476 HG21 HD13 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 63.32 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 103' ' ' PHE . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 33.21 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 62.22 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.476 HD13 HG21 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.11 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 61.44 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.469 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 72.11 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.407 ' HB2' ' HE3' ' A' ' 124' ' ' MET . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 64.33 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 73.23 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 44.41 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 62.11 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.701 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.41 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 54.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 42.54 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 63.34 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 45.45 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.58 ' HE2' HD23 ' B' ' 137' ' ' LEU . 91.6 mttt -108.22 132.34 53.75 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t70 176.62 -31.29 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 125.158 1.383 . . . . 62.43 110.354 -173.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.49 1.559 0 C-N-CA 124.033 0.933 . . . . 73.44 111.921 -172.58 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.441 -0.264 . . . . 64.41 112.441 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.6 m -87.96 106.55 18.2 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.618 0.767 . . . . 74.14 109.879 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.8 145.64 55.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.153 0.581 . . . . 72.11 111.043 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -93.73 -56.26 2.96 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.933 0.493 . . . . 75.11 111.956 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.31 161.77 21.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.016 0.927 . . . . 72.3 112.704 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ASN . . . . . 0.447 HD21 ' HB3' ' B' ' 69' ' ' GLN . 54.6 t-20 -72.37 95.01 1.69 Allowed 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.593 -0.73 . . . . 64.42 109.083 171.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -79.74 83.48 5.69 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 73.23 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.402 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 65.25 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 61.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 50.45 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' SER . . . . . 0.463 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 51.11 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 71.51 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 60.45 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.453 HD11 HD21 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.619 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 74.42 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 71.5 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 61.54 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HB2' HD11 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 60.21 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.535 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 61.23 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.619 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 71.24 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 70.21 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 51.55 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.446 ' O ' HG22 ' B' ' 48' ' ' VAL . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 54.02 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.468 HG23 HD22 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.468 HD22 HG23 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 70.42 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t -60.08 -34.23 73.16 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 73.21 110.957 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -108.7 111.53 60.99 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 123.928 0.891 . . . . 71.51 109.009 162.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -54.52 -32.65 74.87 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 123.232 2.621 . . . . 74.43 113.996 177.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -95.06 -176.79 3.93 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.403 0.681 . . . . 61.14 110.865 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.472 HD13 HH11 ' B' ' 57' ' ' ARG . 0.7 OUTLIER -97.25 69.78 2.3 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 121.568 0.699 . . . . 71.35 111.451 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 54.5 t -92.07 -58.08 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.908 -0.495 . . . . 75.11 110.605 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.404 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 2.9 pp -97.17 27.5 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 C-N-CA 123.741 0.816 . . . . 64.42 111.651 175.677 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.472 HH11 HD13 ' B' ' 54' ' ' LEU . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 63.2 115.34 -172.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.471 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 72.25 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.404 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 50.24 110.721 173.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.518 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 64.31 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.453 HD21 HD11 ' B' ' 30' ' ' ILE . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 71.32 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 54.2 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.552 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 64.02 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 60.31 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.552 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 31.24 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.465 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 60.23 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 73.04 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 54.22 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 73.2 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 61.32 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 62.3 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 71.22 111.046 176.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 73.25 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.21 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 71.13 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.446 ' O ' HG13 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 52.22 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 72.55 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 65.4 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.516 HG23 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 54.4 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.516 HG23 HG23 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 15.41 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 73.23 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 72.23 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 64.31 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 42.12 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.469 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 72.11 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.423 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 71.32 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 105' ' ' MET . . . . . 0.465 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.56 HG21 HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 65.34 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 64.34 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 51.55 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 54.41 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.56 HD13 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 74.52 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 72.04 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 60.3 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.416 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 121' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 73.43 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 65.32 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 53.42 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 62.14 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.457 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 42.42 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.455 HG13 HD11 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 70.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.457 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 72.22 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 71.32 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.548 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 62.33 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 72.41 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.467 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt -113.48 179.92 3.82 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 71.24 111.079 171.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 69.98 12.9 7.89 Favored 'General case' 0 CA--C 1.569 1.675 0 C-N-CA 124.117 0.967 . . . . 51.42 111.928 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.492 1.642 0 C-N-CA 123.263 0.625 . . . . 72.2 112.119 -178.552 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 CA-C-O 119.652 -0.527 . . . . 74.14 113.51 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -89.92 76.45 7.09 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.724 0.762 . . . . 73.52 111.337 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.66 123.3 23.78 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.334 0.654 . . . . 72.41 110.83 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -87.25 -41.32 13.78 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 63.31 111.87 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.79 84.95 6.2 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.101 0.56 . . . . 54.42 110.678 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -73.18 95.3 2.07 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.211 0.605 . . . . 72.04 110.839 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.498 ' HB3' ' N ' ' A' ' 73' ' ' HIS . 13.5 t70 -90.54 69.37 6.78 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 122.343 1.068 . . . . 73.33 109.647 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.57 -16.32 52.01 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 114.64 -1.164 . . . . 74.54 111.99 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 64.43 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.427 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 63.21 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 74.31 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 72.25 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 72.43 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.448 ' HG3' HD12 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 61.45 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 51.5 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 17' ' ' PHE . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 63.34 111.319 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.523 HG22 ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.739 HG11 HD21 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 73.13 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 HD11 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 73.41 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.557 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' HD11 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 51.3 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 71.14 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 74.13 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 64.22 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 72.24 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 73.31 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.12 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 72.34 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 54.23 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 74.43 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 70.5 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.579 HG22 HG23 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 28' ' ' SER . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -86.75 6.43 31.45 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 53.0 112.92 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 56' ' ' ILE . 1.9 m-20 -41.46 108.62 0.59 Allowed Pre-proline 0 N--CA 1.496 1.827 0 C-N-CA 126.082 1.753 . . . . 73.24 114.592 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.42 -29.14 88.1 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.558 2.172 . . . . 74.43 112.559 168.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.406 ' HB3' HG23 ' A' ' 55' ' ' VAL . 81.4 m-20 -155.7 156.13 34.38 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 125.385 1.474 . . . . 71.45 109.864 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -64.27 -9.3 16.59 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.216 0.821 . . . . 73.21 113.216 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.406 HG23 ' HB3' ' A' ' 53' ' ' ASN . 57.7 t -54.18 -40.35 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.079 0.952 . . . . 63.23 112.014 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.518 HD11 ' HA ' ' A' ' 51' ' ' ASP . 40.6 pt -88.27 15.26 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 71.23 113.614 -174.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 65.41 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HE3' ' HD2' ' A' ' 27' ' ' PRO . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 55.22 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.557 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 52.03 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 34.04 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.579 HG23 HG22 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 74.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 74.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.43 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 71.25 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 34.32 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.498 ' N ' ' HB3' ' A' ' 7' ' ' ASP . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 63.03 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 52.11 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.11 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.23 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.405 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 71.13 111.533 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.456 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' HD22 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.739 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 71.32 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.32 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.02 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 42.33 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 62.32 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 102' ' ' VAL . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 74.43 121.139 -164.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 63.44 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 63.32 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 106' ' ' ILE . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 33.21 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 62.22 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.11 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 61.44 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.513 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 72.11 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 64.33 109.694 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 73.23 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 44.41 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 62.11 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.587 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.2 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.41 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 54.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.587 HG22 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 42.54 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.586 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 63.34 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 45.45 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.553 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.5 mtpm? -99.77 172.68 7.11 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -85.08 -58.09 2.83 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.333 -0.848 . . . . 62.43 111.03 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 . . . . . 0 CA--C 1.575 1.925 0 C-N-CA 125.447 1.499 . . . . 73.44 114.289 -174.012 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 CA-C-O 120.012 -0.326 . . . . 64.41 113.054 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -142.89 17.1 1.96 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.348 0.659 . . . . 74.14 112.226 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.8 169.96 13.51 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.983 0.513 . . . . 72.11 112.122 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -55.14 -52.12 64.3 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.585 0.754 . . . . 75.11 112.253 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -88.99 -29.04 19.8 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.471 0.708 . . . . 72.3 112.113 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -58.95 102.04 0.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.28 0.562 . . . . 64.42 110.768 -175.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -94.43 64.96 3.18 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 -172.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 73.23 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 65.25 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 61.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.536 HG21 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 50.45 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.512 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.656 HG11 HD21 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 51.11 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 71.51 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.729 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 60.45 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.439 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 74.42 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 71.5 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 61.54 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 34.8 mm-40 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 60.21 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 61.23 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 71.24 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.427 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 7.1 m120 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 70.21 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 42' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 51.55 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 54.02 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.439 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 70.42 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -63.79 -37.41 87.27 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 73.21 112.448 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.67 152.55 51.85 Favored Pre-proline 0 CA--C 1.562 1.435 0 C-N-CA 123.883 0.873 . . . . 71.51 111.179 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -96.24 37.65 0.13 Allowed 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 123.449 2.766 . . . . 74.43 114.39 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.476 ' HB3' HG23 ' B' ' 55' ' ' VAL . 93.5 m-20 -140.24 144.09 36.32 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 113.217 0.821 . . . . 61.14 113.217 -167.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.586 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.7 pt? -91.32 4.8 51.46 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.634 -0.712 . . . . 71.35 111.933 168.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' VAL . . . . . 0.476 HG23 ' HB3' ' B' ' 53' ' ' ASN . 49.9 t -56.51 -43.15 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.673 0.789 . . . . 75.11 111.31 176.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.427 HG22 HH11 ' B' ' 59' ' ' ARG . 2.8 pp -107.23 22.54 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 124.458 1.103 . . . . 64.42 111.927 -176.412 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.534 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 63.2 112.83 -172.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.504 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 72.25 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.427 HH11 HG22 ' B' ' 56' ' ' ILE . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 50.24 111.528 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.729 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.5 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 64.31 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 71.32 111.956 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 54.2 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 64.02 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 60.31 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 31.24 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.462 ' O ' HG23 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 60.23 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 73.04 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.462 HG23 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 54.22 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 73.2 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 61.32 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 62.3 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 71.22 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 73.25 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.21 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.403 ' HG3' HD22 ' B' ' 90' ' ' LEU . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 71.13 111.299 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.656 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 52.22 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 72.55 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.536 ' NZ ' HG21 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 65.4 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.461 HG22 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 54.4 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.438 HG23 HG23 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 15.41 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 73.23 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 72.23 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.524 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 64.31 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 42.12 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 72.11 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.428 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 71.32 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.42 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 65.34 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 64.34 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 51.55 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 54.41 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 106' ' ' ILE . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 74.52 111.874 178.232 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 72.04 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 60.3 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.495 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 73.43 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 65.32 110.475 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.495 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 53.42 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 62.14 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.535 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 42.42 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.729 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.6 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 70.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 72.22 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 71.32 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.729 HG22 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 62.33 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 72.41 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.553 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 9.6 mtpm? -92.59 178.08 5.92 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 71.24 110.896 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -126.4 62.27 1.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.832 0.825 . . . . 51.42 109.459 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 . . . . . 0 CA--C 1.567 1.601 0 CA-C-N 115.128 -0.942 . . . . 72.2 111.407 172.018 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 CA-C-O 120.361 -0.133 . . . . 74.14 113.322 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 p -158.04 -73.04 0.09 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.191 0.596 . . . . 73.52 109.97 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 67.87 -1.61 1.66 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 116.118 1.896 . . . . 72.41 116.118 165.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -91.25 -46.04 8.28 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 118.195 0.452 . . . . 63.31 110.868 175.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -82.33 72.11 9.39 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 121.748 0.785 . . . . 54.42 110.449 178.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -74.55 -59.0 2.93 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.855 -1.066 . . . . 72.04 112.09 -175.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -147.68 17.05 1.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 112.972 0.731 . . . . 73.33 112.972 -170.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -57.92 -19.77 32.39 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 177.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 64.43 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 63.21 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 74.31 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 72.25 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 72.43 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.594 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 61.45 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 51.5 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.454 HD11 HG11 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 63.34 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.703 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 73.13 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 73.41 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.643 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.48 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.672 HG22 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 51.3 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 71.14 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 74.13 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.403 ' HG2' HD22 ' A' ' 40' ' ' LEU . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 64.22 111.216 170.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 72.24 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.418 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 73.31 112.85 172.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.672 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.12 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 72.34 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 54.23 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 74.43 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.615 ' HB3' HD21 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 70.5 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 19.8 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t -70.61 -33.87 71.5 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 53.0 109.531 170.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.97 106.56 43.35 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.164 1.386 . . . . 73.24 108.147 171.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -63.02 -23.17 73.97 Favored 'Trans proline' 0 N--CA 1.504 2.094 0 C-N-CA 122.926 2.417 . . . . 74.43 115.093 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.35 175.22 10.03 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.742 0.817 . . . . 71.45 112.626 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.602 ' HB2' ' HD3' ' A' ' 57' ' ' ARG . 2.2 pt? -100.95 17.68 21.62 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.018 0.527 . . . . 73.21 112.126 -171.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.53 -55.1 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.394 0.678 . . . . 63.23 111.375 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt -107.94 25.24 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.546 0.738 . . . . 71.23 112.27 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.602 ' HD3' ' HB2' ' A' ' 54' ' ' LEU . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 65.41 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 55.22 112.634 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 52.03 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 34.04 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.643 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 74.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 74.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.43 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 71.25 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 34.32 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG23 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.529 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 63.03 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 52.11 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.11 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.23 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 71.13 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD22 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.703 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.624 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 71.32 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 20' ' ' THR . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.32 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.594 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.02 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.446 HG23 HG23 ' A' ' 94' ' ' VAL . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 42.33 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.584 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.584 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 62.32 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.515 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 74.43 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.467 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 63.44 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 63.32 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 33.21 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HA ' HD12 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 62.22 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.11 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 61.44 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.504 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 72.11 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.429 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 64.33 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 73.23 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 44.41 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 62.11 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.41 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 54.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.562 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 42.54 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 63.34 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 45.45 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.13 168.57 11.86 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -101.65 6.37 41.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.002 0.521 . . . . 62.43 111.749 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 124.064 0.946 . . . . 73.44 111.733 -170.594 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 113.888 0.315 . . . . 64.41 113.888 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -71.77 -54.97 8.51 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.446 0.698 . . . . 74.14 111.52 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.25 157.39 19.32 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.469 0.707 . . . . 72.11 111.337 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -94.67 -48.98 5.83 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.113 0.965 . . . . 75.11 110.128 178.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -72.65 98.86 2.43 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 121.215 0.531 . . . . 72.3 111.196 178.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -159.94 171.93 18.49 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.121 0.968 . . . . 64.42 110.277 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -106.04 90.32 3.33 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 73.23 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.432 HD21 HD21 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 65.25 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 61.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.465 HG21 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 50.45 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.694 HD23 HD12 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.485 HG11 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 51.11 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 71.51 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.652 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 60.45 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.47 HG12 ' HA ' ' B' ' 27' ' ' PRO . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 74.42 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 71.5 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 61.54 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.665 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 60.21 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.625 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 61.23 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 71.24 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 70.21 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 51.55 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 54.02 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.6 HG22 HG23 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.528 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 70.42 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -79.31 -28.81 42.17 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 73.21 108.913 163.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -124.78 116.01 26.44 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 125.279 1.431 . . . . 71.51 108.983 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.19 -10.8 17.76 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 122.502 2.135 . . . . 74.43 112.529 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.54 -179.02 7.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.007 0.923 . . . . 61.14 111.05 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.654 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.5 pt? -94.7 15.62 17.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 112.358 0.503 . . . . 71.35 112.358 178.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -66.62 -45.31 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.076 0.55 . . . . 75.11 111.624 -174.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -119.37 26.61 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 64.42 112.715 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.489 ' HD3' ' HB2' ' B' ' 54' ' ' LEU . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 63.2 113.312 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.582 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 72.25 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 50.24 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.652 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 64.31 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.6 HG23 HG22 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 71.32 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 54.2 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 64.02 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 60.31 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 31.24 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.497 ' HB3' HG12 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 60.23 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.445 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 73.04 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 54.22 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 73.2 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.538 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 61.32 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 62.3 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.529 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 71.22 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 73.25 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.21 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 71.13 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.694 HD12 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 52.22 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.463 ' HA ' HG22 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 72.55 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.465 ' HE3' HG21 ' B' ' 20' ' ' THR . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 65.4 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 54.4 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.425 HG23 HG23 ' B' ' 94' ' ' VAL . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 15.41 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 73.23 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 72.23 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.453 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 64.31 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 42.12 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 72.11 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.529 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 71.32 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.517 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 65.34 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 64.34 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.625 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 51.55 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 54.41 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.517 HD13 HG21 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 74.52 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 72.04 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 60.3 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.484 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 73.43 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.468 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 65.32 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 53.42 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 67.7 tp60 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 62.14 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' B' ' 124' ' ' MET . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 42.42 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.491 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 70.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 72.22 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 71.32 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.491 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 62.33 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 72.41 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -78.72 167.01 21.84 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 71.24 112.615 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.03 -22.52 36.4 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-N 114.623 -1.171 . . . . 51.42 111.225 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.566 1.584 0 C-N-CA 123.775 0.83 . . . . 72.2 111.51 177.631 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 CA-C-O 119.8 -0.445 . . . . 74.14 112.322 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 m -157.73 164.64 36.89 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.68 0.792 . . . . 73.52 111.209 177.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -93.1 -75.52 0.49 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.249 0.62 . . . . 72.41 111.175 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -94.52 -22.38 18.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.918 0.887 . . . . 63.31 111.994 -173.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -61.47 134.09 56.48 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.363 0.665 . . . . 54.42 112.353 -178.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -84.58 11.49 8.73 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 123.636 0.774 . . . . 72.04 111.986 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -56.63 135.89 54.83 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.891 1.276 . . . . 73.33 113.625 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.453 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 -82.15 -13.45 57.18 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 122.857 0.463 . . . . 74.54 111.766 167.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 64.43 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 63.21 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 74.31 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 72.25 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 72.43 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.429 ' HA ' HD12 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 61.45 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 51.5 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 63.34 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG11 HD21 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 73.13 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 HD11 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 73.41 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.659 ' HB3' HD22 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.536 HG23 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 51.3 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.444 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 71.14 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 74.13 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 64.22 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 26.2 mm-40 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 72.24 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 73.31 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.12 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 72.34 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 54.23 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 74.43 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 70.5 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -60.63 -33.67 73.13 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 53.0 111.406 174.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -93.82 108.33 34.01 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 123.424 0.69 . . . . 73.24 110.556 170.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -72.08 -27.13 17.41 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.594 2.196 . . . . 74.43 112.982 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -73.16 142.59 47.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.184 0.593 . . . . 71.45 112.26 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HB2' ' HD2' ' A' ' 57' ' ' ARG . 2.2 pt? -77.66 2.04 17.97 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.533 0.733 . . . . 73.21 112.629 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -53.73 -50.28 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 124.088 0.955 . . . . 63.23 112.025 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt -107.31 22.6 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 71.23 112.497 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.64 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 65.41 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 63' ' ' VAL . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 55.22 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 52.03 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 34.04 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.589 HG12 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.659 HD22 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 74.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 74.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.43 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 71.25 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 34.32 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 63.03 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 52.11 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.11 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.589 HD11 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.23 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.62 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 71.13 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' A' ' 90' ' ' LEU . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.441 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 71.32 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.595 ' HD3' HD13 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.32 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.593 HG23 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.02 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.593 HG23 HG23 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 42.33 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.449 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 62.32 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 74.43 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.517 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 63.44 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 63.32 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.666 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 33.21 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.666 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 62.22 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.11 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 61.44 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.48 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 72.11 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 64.33 109.955 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 73.23 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 44.41 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 62.11 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.522 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.41 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 54.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.522 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 42.54 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 63.34 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 45.45 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -77.62 146.12 36.35 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 60.86 7.03 1.33 Allowed 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 125.049 1.339 . . . . 62.43 113.383 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 123.064 0.546 . . . . 73.44 110.83 -172.031 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.033 0 N-CA-C 112.782 -0.127 . . . . 64.41 112.782 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -120.81 90.99 3.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.63 0.772 . . . . 74.14 109.877 177.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -98.86 148.37 24.0 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.552 0.741 . . . . 72.11 110.694 -177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -109.88 95.69 5.76 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.994 0.918 . . . . 75.11 109.674 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -107.0 166.48 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.653 -1.158 . . . . 72.3 112.206 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -104.97 21.91 16.2 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.414 1.086 . . . . 64.42 110.457 171.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -66.26 128.98 38.25 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.402 1.081 . . . . 63.54 113.293 -168.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 73.23 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 65.25 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 61.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 50.45 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.524 HG22 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.589 HG11 HD21 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 51.11 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 71.51 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.478 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 60.45 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.522 ' HG3' HG23 ' B' ' 30' ' ' ILE . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 74.42 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.494 HD13 HD21 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 71.5 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 61.54 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.453 ' HG3' HD11 ' B' ' 118' ' ' LEU . 27.0 mm-40 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 60.21 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.61 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 61.23 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.655 HD12 HD11 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 71.24 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 70.21 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 51.55 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 54.02 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.556 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 70.42 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t -68.04 -4.31 12.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 73.21 112.452 170.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -133.39 84.25 47.19 Favored Pre-proline 0 CA--C 1.56 1.332 0 C-N-CA 124.192 0.997 . . . . 71.51 109.64 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -77.03 -21.15 12.44 Favored 'Trans proline' 0 CA--C 1.56 1.782 0 C-N-CA 122.764 2.309 . . . . 74.43 112.937 174.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -86.74 19.24 3.01 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.651 0.78 . . . . 61.14 113.092 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.658 ' HB2' ' HD2' ' B' ' 57' ' ' ARG . 0.6 OUTLIER 39.31 43.01 0.88 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 126.031 1.732 . . . . 71.35 115.146 175.729 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.43 -45.21 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.507 0.723 . . . . 75.11 110.494 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -120.98 24.96 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.582 1.153 . . . . 64.42 112.134 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.658 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 63.2 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.469 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 72.25 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 50.24 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.478 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.524 ' HB ' HG22 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 64.31 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.655 HD11 HD12 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 71.32 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 54.2 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 64.02 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.494 HD21 HD13 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 60.31 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 31.24 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' LYS . . . . . 0.577 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 60.23 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 73.04 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 54.22 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 73.2 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 61.32 110.737 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 62.3 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 71.22 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' TYR . . . . . 0.505 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 73.25 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.21 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 71.13 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.589 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 52.22 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.583 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 72.55 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.587 ' HD3' HD13 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 65.4 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.403 HG23 HG23 ' B' ' 95' ' ' THR . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 54.4 112.309 174.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.403 HG23 HG23 ' B' ' 94' ' ' VAL . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 15.41 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 73.23 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 72.23 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 64.31 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 42.12 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 101' ' ' ARG . . . . . 0.436 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 72.11 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.447 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 71.32 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 105' ' ' MET . . . . . 0.461 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.447 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 65.34 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 64.34 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.61 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 51.55 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 54.41 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 74.52 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 72.04 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.453 HD11 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 60.3 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 73.43 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.425 ' HB2' ' HE2' ' B' ' 124' ' ' MET . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 65.32 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 53.42 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 62.14 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 42.42 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 126' ' ' LEU . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.485 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 70.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 72.22 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 71.32 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.485 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 62.33 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.538 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 72.41 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -105.24 -72.89 0.7 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 71.24 110.647 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -115.66 9.63 15.31 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.423 1.089 . . . . 51.42 109.941 172.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 CA--C 1.562 1.438 0 C-N-CA 124.747 1.219 . . . . 72.2 108.905 -173.705 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 CA-C-O 120.441 -0.088 . . . . 74.14 112.954 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -88.26 107.83 19.0 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.168 0.587 . . . . 73.52 110.948 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -91.95 139.32 30.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.307 0.643 . . . . 72.41 111.048 174.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -69.85 -33.28 72.06 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.281 0.632 . . . . 63.31 110.95 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -119.96 121.81 39.8 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.887 0.875 . . . . 54.42 111.074 -173.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -77.97 155.84 30.56 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.155 0.582 . . . . 72.04 110.155 167.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.433 ' O ' ' SG ' ' A' ' 10' ' ' CYS . 3.6 p-10 -85.94 74.3 10.17 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-O 122.958 1.361 . . . . 73.33 110.531 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.492 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 -80.03 -12.64 59.68 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 115.178 -0.919 . . . . 74.54 111.412 173.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 64.43 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' ' O ' ' A' ' 7' ' ' ASP . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 63.21 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 74.31 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 72.25 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 72.43 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' HG12 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 61.45 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.474 HG21 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 51.5 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 63.34 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.725 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.513 HG11 HD21 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 73.13 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 73.41 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.483 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 51.3 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 71.14 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 74.13 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 64.22 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 72.24 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 73.31 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD11 HG22 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.12 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 72.34 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 54.23 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 74.43 112.043 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 70.5 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t -120.38 8.67 10.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 53.0 109.856 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -76.13 140.23 69.57 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 124.981 1.313 . . . . 73.24 111.833 -177.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -86.56 9.22 4.09 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.98 2.453 . . . . 74.43 113.623 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 175.91 165.52 0.38 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.487 1.115 . . . . 71.45 108.345 -169.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.3 mt -95.39 37.06 1.2 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.528 0.731 . . . . 73.21 112.017 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.13 -43.46 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 123.4 0.68 . . . . 63.23 111.05 -177.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt -90.13 27.45 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 71.23 113.224 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.725 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 65.41 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 55.22 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.486 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 52.03 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 34.04 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 74.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.444 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 74.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.43 111.411 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLN . . . . . 0.492 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 71.25 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.466 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 34.32 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HE2' ' HB ' ' A' ' 71' ' ' THR . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 63.03 110.751 169.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.61 ' HA ' HD12 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 52.11 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.403 ' OE2' ' HA ' ' A' ' 103' ' ' PHE . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.11 110.851 171.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.23 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 99' ' ' PRO . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HB2' ' HZ ' ' A' ' 103' ' ' PHE . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 71.13 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.614 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 71.32 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.32 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.639 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.02 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.639 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 42.33 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.614 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HA ' ' HG3' ' A' ' 84' ' ' GLU . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 62.32 112.301 167.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 74.43 111.919 -169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 63.44 110.988 176.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 63.32 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.459 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.634 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 33.21 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 62.22 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.11 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 61.44 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 72.11 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.452 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 64.33 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 73.23 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 44.41 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 62.11 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.41 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 54.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 42.54 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.641 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 63.34 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 45.45 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.94 163.46 15.57 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 59.81 20.49 9.34 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.588 1.155 . . . . 62.43 112.867 -176.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.574 1.871 0 C-N-CA 124.448 1.099 . . . . 73.44 112.591 -178.537 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 114.182 0.433 . . . . 64.41 114.182 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -152.04 30.85 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.909 0.883 . . . . 74.14 110.002 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.88 105.62 2.04 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.772 0.829 . . . . 72.11 111.225 -174.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -76.97 -52.66 9.0 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.898 0.879 . . . . 75.11 111.049 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -87.03 112.57 21.99 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.791 0.836 . . . . 72.3 111.45 -175.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ASN . . . . . 0.531 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 86.8 m-20 -69.63 128.11 35.32 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.998 -0.742 . . . . 64.42 108.998 168.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -75.53 118.75 18.73 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 -171.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 73.23 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.605 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 65.25 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.504 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.605 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 61.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 50.45 110.364 174.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.693 HG22 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.487 HG11 HD21 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 51.11 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.574 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 71.51 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.597 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 60.45 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.517 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 74.42 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.492 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 71.5 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 61.54 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.568 ' HG3' HD21 ' B' ' 118' ' ' LEU . 85.4 mm-40 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 60.21 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.565 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 61.23 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.517 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 71.24 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 70.21 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 51.55 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 54.02 111.768 -173.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.477 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.456 HG22 HG23 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 70.42 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t -68.28 -34.37 76.05 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 73.21 112.761 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -52.32 123.07 27.23 Favored Pre-proline 0 CA--C 1.562 1.406 0 N-CA-C 114.023 1.12 . . . . 71.51 114.023 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -67.94 -75.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.564 2.007 0 C-N-CA 121.914 1.743 . . . . 74.43 109.719 156.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -94.61 179.51 5.24 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.807 -0.812 . . . . 61.14 108.807 161.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.446 HD13 ' NH1' ' B' ' 57' ' ' ARG . 34.0 mt -93.35 72.28 4.48 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.163 -0.961 . . . . 71.35 112.12 -165.714 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 39.7 t -98.68 -44.24 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.472 0.709 . . . . 75.11 111.288 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt -107.42 27.23 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 124.628 1.171 . . . . 64.42 111.94 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.446 ' NH1' HD13 ' B' ' 54' ' ' LEU . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 72.25 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 50.24 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.693 ' HB ' HG22 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 64.31 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.456 HG23 HG22 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' LEU . . . . . 0.42 HD22 ' HG3' ' B' ' 27' ' ' PRO . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 71.32 111.048 172.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 54.2 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 64.02 111.58 176.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 60.31 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 31.24 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' HIS . . . . . 0.531 ' H ' ' HB3' ' B' ' 6' ' ' ASN . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 60.23 111.559 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.449 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 73.04 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 54.22 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 73.2 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.512 ' HB2' HG11 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 61.32 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.508 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 62.3 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.548 ' HA ' ' HE1' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 71.22 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 73.25 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.21 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 71.13 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.487 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 52.22 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.47 ' HA ' HG22 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 92' ' ' LYS . . . . . 0.575 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 72.55 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 65.4 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.615 HG23 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 54.4 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.615 HG23 HG23 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 15.41 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 73.23 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 72.23 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 64.31 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 100' ' ' ALA . . . . . 0.406 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 42.12 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 72.11 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.512 HG11 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.42 ' O ' HG12 ' B' ' 107' ' ' ILE . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 71.32 114.626 -169.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 103' ' ' PHE . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 65.34 110.789 172.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 64.34 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.565 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 51.55 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 54.41 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 74.52 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 72.04 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.568 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 60.3 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.478 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 73.43 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.525 HG21 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 65.32 110.389 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 53.42 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 62.14 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 42.42 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.504 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 70.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 72.22 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.528 HD13 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 71.32 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.504 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 62.33 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.61 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 72.41 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -92.12 -52.9 4.48 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 71.24 110.379 178.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -168.26 -49.32 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 113.625 -1.625 . . . . 51.42 108.192 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 CA--C 1.573 1.846 0 C-N-CA 125.671 1.588 . . . . 72.2 114.416 169.13 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.111 0 CA-C-O 119.909 -0.384 . . . . 74.14 112.965 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 t -105.63 113.85 27.66 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.348 0.659 . . . . 73.52 110.015 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -138.08 -160.7 1.09 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.44 1.096 . . . . 72.41 110.93 -175.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -62.46 -41.68 98.93 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.481 0.712 . . . . 63.31 111.175 177.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -69.06 110.51 4.53 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.619 0.768 . . . . 54.42 111.065 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -73.56 84.89 1.56 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.762 -0.829 . . . . 72.04 108.762 170.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -83.39 125.72 31.97 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-O 121.402 0.62 . . . . 73.33 111.276 -172.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.93 -11.28 59.6 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 116.133 -0.485 . . . . 74.54 111.226 168.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 64.43 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.661 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 63.21 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 74.31 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 72.25 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.661 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 72.43 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 61.45 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 51.5 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.454 HD23 HD12 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 63.34 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 73.13 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.405 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 73.41 110.917 -173.636 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.592 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 51.3 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 71.14 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 74.13 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 64.22 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 118' ' ' LEU . 86.3 mm-40 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 72.24 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.622 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 73.31 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.12 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 72.34 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 54.23 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.504 ' HB3' HD13 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 74.43 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 70.5 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t -60.82 -34.1 74.03 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 53.0 112.094 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 12.0 t70 -94.4 136.18 23.57 Favored Pre-proline 0 CA--C 1.561 1.385 0 C-N-CA 124.019 0.927 . . . . 73.24 109.665 171.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -85.79 -44.64 0.05 OUTLIER 'Trans proline' 0 CA--C 1.571 2.349 0 C-N-CA 122.707 2.271 . . . . 74.43 114.837 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -61.22 147.19 45.15 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.531 1.308 . . . . 71.45 114.531 -166.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 2.5 pt? -75.86 -7.67 55.06 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.663 -1.153 . . . . 73.21 112.834 175.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.8 -42.17 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 123.331 0.653 . . . . 63.23 111.293 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.42 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt -114.21 23.72 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.107 0.563 . . . . 71.23 112.019 175.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 54' ' ' LEU . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 65.41 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.584 ' HD3' ' HB3' ' A' ' 51' ' ' ASP . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 55.22 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.592 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 34.04 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 74.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.504 HD13 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 74.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.43 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.47 ' NH2' HG23 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 71.25 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 34.32 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 63.03 111.009 170.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 52.11 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB2' HG11 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.11 111.621 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 83' ' ' LEU . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.23 110.494 -177.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.47 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 71.13 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.591 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 71.32 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.531 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.32 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.02 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.689 HG23 HG23 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 42.33 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 62.32 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 0.542 HG11 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 74.43 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' MET . . . . . 0.44 ' HB2' ' HE2' ' A' ' 105' ' ' MET . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 63.44 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.401 ' O ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 63.32 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 33.21 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 62.22 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 92.4 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.11 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.525 HD21 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 61.44 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 72.11 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 119' ' ' LEU . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 64.33 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.439 ' O ' HG23 ' A' ' 130' ' ' VAL . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 73.23 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 44.41 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.527 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 62.11 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.74 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.41 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 54.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 42.54 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 63.34 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 45.45 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.461 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm -100.82 -45.11 5.56 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 58.75 92.48 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.882 1.273 . . . . 62.43 111.238 -174.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 CA--C 1.567 1.602 0 C-N-CA 125.163 1.385 . . . . 73.44 111.943 -171.711 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.082 0 CA-C-O 120.803 0.113 . . . . 64.41 113.017 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -83.68 28.29 0.58 Allowed 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 123.752 0.821 . . . . 74.14 112.91 -175.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -59.55 134.66 57.22 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.192 0.997 . . . . 72.11 112.494 -177.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -86.42 -51.18 6.37 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 122.908 0.483 . . . . 75.11 110.172 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.71 123.14 17.63 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.009 0.924 . . . . 72.3 111.678 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ASN . . . . . 0.602 ' HB3' ' HA3' ' B' ' 72' ' ' GLY . 11.2 m120 -59.0 98.22 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 125.158 1.383 . . . . 64.42 112.517 -176.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -100.09 113.96 26.96 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 -175.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 73.23 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 65.25 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' PHE . . . . . 0.4 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 61.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' THR . . . . . 0.4 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 50.45 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.467 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.685 HG11 HD21 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 51.11 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 71.51 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 60.45 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.518 HG22 HD11 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 74.42 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.464 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.496 HD13 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 71.5 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 61.54 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.614 ' HG3' HD21 ' B' ' 118' ' ' LEU . 80.6 mm-40 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 60.21 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.508 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 61.23 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.518 HD11 HG22 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 71.24 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' HD23 ' B' ' 40' ' ' LEU . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 70.21 110.157 176.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 51.55 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 54.02 112.079 -177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 70.42 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -58.95 -34.75 72.13 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 73.21 110.738 166.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.531 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 2.4 m-20 -120.68 90.24 45.9 Favored Pre-proline 0 CA--C 1.559 1.316 0 N-CA-C 107.236 -1.394 . . . . 71.51 107.236 168.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -87.94 -11.45 4.62 Favored 'Trans proline' 0 CA--C 1.556 1.613 0 C-N-CA 123.02 2.48 . . . . 74.43 114.994 -170.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -62.0 157.29 19.06 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 113.662 0.986 . . . . 61.14 113.662 -168.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.713 ' HA ' ' HD2' ' B' ' 57' ' ' ARG . 2.1 pt? -59.88 -21.63 61.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 114.558 -1.201 . . . . 71.35 113.65 -177.093 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -64.5 -48.9 83.09 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.823 0.849 . . . . 75.11 111.17 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' ILE . . . . . 0.429 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp -122.82 7.17 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 64.42 113.954 -173.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.713 ' HD2' ' HA ' ' B' ' 54' ' ' LEU . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 63.2 111.689 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 72.25 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 50.24 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.531 ' HE3' ' HB2' ' B' ' 51' ' ' ASP . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.467 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 64.31 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' B' ' 60' ' ' LYS . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 71.32 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 54.2 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' ASP . . . . . 0.573 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' ILE . . . . . 0.558 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 64.02 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.496 HD21 HD13 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 60.31 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLY . . . . . 0.602 ' HA3' ' HB3' ' B' ' 6' ' ' ASN . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 31.24 114.75 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 60.23 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 73.04 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 54.22 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 73.2 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.532 ' HB2' HG11 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 61.32 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 62.3 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.406 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 71.22 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 73.25 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' TYR . . . . . 0.542 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.21 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' GLN . . . . . 0.425 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 71.13 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.685 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 52.22 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 72.55 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.544 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 65.4 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 94' ' ' VAL . . . . . 0.467 HG23 HG23 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 54.4 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 95' ' ' THR . . . . . 0.467 HG23 HG23 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 15.41 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 73.23 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 72.23 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 64.31 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 42.12 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 72.11 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 102' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.516 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 71.32 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.435 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.516 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 65.34 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 64.34 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 51.55 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 54.41 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 74.52 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 72.04 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 118' ' ' LEU . . . . . 0.614 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 60.3 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 120' ' ' MET . . . . . 0.447 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 73.43 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.47 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 65.32 110.445 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.459 ' O ' HG23 ' B' ' 130' ' ' VAL . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 53.42 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 127' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 62.14 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 42.42 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 18.9 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 70.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 132' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 72.22 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 71.32 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 62.33 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 72.41 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.461 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm -97.71 -47.45 5.6 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 71.24 112.815 -171.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 30.2 t70 59.17 37.31 24.01 Favored 'General case' 0 CA--C 1.566 1.582 0 O-C-N 124.466 1.104 . . . . 51.42 111.085 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 CA--C 1.566 1.559 0 C-N-CA 124.99 1.316 . . . . 72.2 112.351 -175.756 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 CA-C-O 120.089 -0.284 . . . . 74.14 112.525 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.5 m -86.07 55.96 3.77 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.4 0.68 . . . . 73.52 110.828 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -152.46 173.24 15.37 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.713 0.805 . . . . 72.41 110.822 -176.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.33 -3.19 40.93 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.716 0.807 . . . . 63.31 112.346 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.86 18.46 13.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.597 0.759 . . . . 54.42 111.85 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -57.74 110.29 0.87 Allowed 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.858 0.863 . . . . 72.04 111.259 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.01 96.86 0.1 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.509 0.929 . . . . 73.33 113.509 -177.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -80.62 -21.45 41.5 Favored 'General case' 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 151.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 64.43 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 63.21 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 74.31 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 72.25 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 72.43 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.471 ' HG2' HD12 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 61.45 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 51.5 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.616 HD23 HD12 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 63.34 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.456 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.455 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 73.13 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 73.41 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.782 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 27' ' ' PRO . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 51.3 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 71.14 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 74.13 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 64.22 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 72.24 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 73.31 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.799 HD21 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.12 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 72.34 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 54.23 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.66 ' HB3' HD13 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 74.43 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.799 ' HB3' HD21 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 70.5 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.438 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t -58.11 -31.73 67.43 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 53.0 110.734 169.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HB3' ' ND2' ' A' ' 53' ' ' ASN . 17.7 m-20 -114.74 91.05 24.14 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 123.731 0.812 . . . . 73.24 110.106 169.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -59.8 -17.0 40.88 Favored 'Trans proline' 0 C--N 1.378 2.108 0 C-N-CA 122.857 2.371 . . . . 74.43 114.511 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.444 ' ND2' ' HB3' ' A' ' 51' ' ' ASP . 10.2 p30 -62.74 155.16 27.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 113.369 0.877 . . . . 71.45 113.369 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HB2' HH11 ' A' ' 57' ' ' ARG . 2.1 pt? -95.37 22.88 6.4 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.503 0.721 . . . . 73.21 112.05 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.3 t -81.28 -56.34 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 122.093 -0.379 . . . . 63.23 111.251 -179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt -92.62 24.82 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 71.23 114.082 -171.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.654 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.456 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 65.41 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.654 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 55.22 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.782 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 52.03 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 34.04 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 74.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 74.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.43 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 71.25 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 34.32 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 63.03 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.414 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 52.11 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.11 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.23 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . 0.532 ' HB3' HD23 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 71.13 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' PRO . . . . . 0.763 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD22 ' A' ' 90' ' ' LEU . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 95' ' ' THR . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LYS . . . . . 0.409 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 71.32 112.224 177.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.436 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.32 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.02 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 42.33 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.467 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 62.32 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.763 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 74.43 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . 0.438 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 63.44 111.412 170.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 63.32 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.481 HG23 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 33.21 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.481 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 62.22 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.457 ' HB2' HD12 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.11 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 61.44 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.406 ' O ' HG22 ' A' ' 123' ' ' VAL . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 72.11 112.895 176.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' VAL . . . . . 0.496 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' MET . . . . . 0.426 ' HE2' ' HB2' ' A' ' 124' ' ' MET . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 64.33 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 73.23 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 44.41 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 62.11 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLN . . . . . 0.545 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.41 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 54.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 42.54 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.547 ' HB2' HD11 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 63.34 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 137' ' ' LEU . . . . . 0.507 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 45.45 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.445 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.2 mtpm? -84.88 169.14 14.41 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -100.82 44.82 1.0 Allowed 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 114.947 -1.024 . . . . 62.43 109.644 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.566 1.594 0 C-N-CA 125.487 1.515 . . . . 73.44 111.605 -177.438 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 119.851 -0.416 . . . . 64.41 113.159 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 72.52 4.45 5.0 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.199 1.399 . . . . 74.14 113.516 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -102.43 -161.51 0.85 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.807 0.843 . . . . 72.11 111.085 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -77.74 -47.72 18.37 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.122 0.569 . . . . 75.11 111.984 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -111.01 88.68 2.84 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.314 0.578 . . . . 72.3 110.635 -174.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -94.36 96.8 9.77 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.128 0.571 . . . . 64.42 109.676 -178.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -79.42 77.29 5.98 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 -173.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 73.23 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 65.25 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.42 ' O ' HG23 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 61.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 50.45 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' LEU . . . . . 0.731 HD23 HD12 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.566 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' VAL . . . . . 0.506 HG11 HD21 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 51.11 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ASP . . . . . 0.454 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 71.51 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.853 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 60.45 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ILE . . . . . 0.691 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' THR . . . . . 0.411 ' HA ' HD13 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 74.42 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.543 HD13 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 71.5 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 61.54 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 60.21 111.226 170.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 61.23 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 71.24 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 70.21 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 51.55 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 54.02 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.563 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 70.42 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t -60.41 -33.22 72.19 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 73.21 110.308 167.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' ASP . . . . . 0.484 ' HB3' HD21 ' B' ' 53' ' ' ASN . 11.4 m-20 -121.35 93.14 48.8 Favored Pre-proline 0 CA--C 1.561 1.391 0 C-N-CA 124.189 0.995 . . . . 71.51 109.13 169.654 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.77 -10.57 28.69 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 123.255 2.636 . . . . 74.43 114.849 -178.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.484 HD21 ' HB3' ' B' ' 51' ' ' ASP . 9.2 p30 -68.83 153.84 43.06 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.677 0.791 . . . . 61.14 112.488 -177.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' LEU . . . . . 0.637 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.0 pt? -87.5 5.59 38.35 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.105 0.562 . . . . 71.35 111.631 178.554 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -73.81 -35.9 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 C-N-CA 123.333 0.653 . . . . 75.11 110.93 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp -104.61 21.72 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 123.8 0.84 . . . . 64.42 111.979 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.454 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 63.2 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' LYS . . . . . 0.519 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 72.25 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 50.24 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.428 ' HD2' ' HD2' ' B' ' 27' ' ' PRO . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.853 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 64.31 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 71.32 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.408 HD12 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 54.2 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 64.02 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 0.543 HD11 HD13 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 60.31 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 70' ' ' ARG . . . . . 0.566 ' HG3' HG23 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.566 HG23 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 31.24 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 60.23 111.297 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 73.04 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 54.22 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 73.2 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 81' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 61.32 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 62.3 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.624 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 71.22 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 73.25 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.21 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 71.13 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' LEU . . . . . 0.731 HD12 HD23 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 52.22 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 91' ' ' TYR . . . . . 0.403 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 72.55 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 93' ' ' LYS . . . . . 0.453 ' HD2' HD13 ' B' ' 90' ' ' LEU . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 65.4 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 54.4 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 15.41 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 73.23 111.997 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 72.23 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 99' ' ' PRO . . . . . 0.403 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 64.31 112.654 172.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 42.12 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 72.11 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 71.32 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ILE . . . . . 0.516 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 65.34 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 64.34 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 51.55 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 54.41 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 115' ' ' LEU . . . . . 0.516 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 74.52 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 72.04 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 60.3 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.624 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 73.43 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 123' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 124' ' ' MET . . . . . 0.437 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 65.32 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 126' ' ' LEU . . . . . 0.418 ' O ' HG23 ' B' ' 130' ' ' VAL . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 53.42 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 127' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 62.14 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 128' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 129' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 42.42 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 130' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 126' ' ' LEU . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 131' ' ' GLN . . . . . 0.592 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 70.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 72.22 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 133' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 71.32 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 134' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 62.33 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 136' ' ' LEU . . . . . 0.507 ' HB2' HD11 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 137' ' ' LEU . . . . . 0.547 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 72.41 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 140' ' ' LYS . . . . . 0.445 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt -77.58 165.81 23.83 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 71.24 113.775 -175.229 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -113.31 -36.23 5.07 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 113.476 -1.693 . . . . 51.42 109.125 171.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.42 0 C-N-CA 124.024 0.93 . . . . 72.2 110.654 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 120.338 0.114 . . . . 74.54 111.082 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 64.43 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.591 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 63.21 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 74.31 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 72.25 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 72.43 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 61.45 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 51.5 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 63.34 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.643 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.556 HG11 HD21 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 73.13 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 73.41 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 HD11 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 51.3 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 71.14 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 74.13 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 64.22 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 72.24 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 73.31 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.12 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 72.34 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 54.23 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 74.43 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 70.5 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 53.0 110.744 173.434 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.475 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt . . . . . 0 CA--C 1.56 1.329 0 N-CA-C 111.676 0.25 . . . . 71.23 111.676 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 65.41 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.475 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.595 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 55.22 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.643 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 52.03 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 34.04 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 74.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 74.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.423 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.43 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 71.25 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 34.32 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.591 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 63.03 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 52.11 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.407 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.11 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.23 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.503 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 71.13 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.56 ' HG3' HD22 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.56 HD22 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 71.32 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.32 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.02 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 42.33 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.455 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 62.32 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 74.43 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.499 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.407 ' HB3' ' OE1' ' A' ' 81' ' ' GLU . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 63.44 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 63.32 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 33.21 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 62.22 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.11 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 61.44 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.636 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 72.11 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.503 ' HG2' HD21 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 64.33 110.985 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 73.23 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 44.41 110.367 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 62.11 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.41 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 54.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 42.54 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.42 ' HB2' HD11 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 63.34 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 45.45 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.439 ' HD2' HD23 ' B' ' 137' ' ' LEU . 10.0 mtpm? . . . . . 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 N--CA 1.48 1.044 0 N-CA-C 109.658 -0.497 . . . . 63.54 109.658 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.528 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 73.23 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 65.25 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 61.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.445 HG21 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 50.45 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.552 HD23 HD12 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.47 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.76 HG11 HD21 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 51.11 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.471 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 71.51 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.688 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 60.45 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.471 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.688 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 74.42 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.474 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 71.5 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 61.54 110.97 169.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.58 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 60.21 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.605 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 61.23 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.476 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 71.24 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 70.21 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 51.55 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.428 ' HB3' HG21 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 54.02 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.476 ' HB3' HD21 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 70.42 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 73.21 109.851 168.558 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.426 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt . . . . . 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 64.42 112.798 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 63.2 114.231 -178.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 72.25 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 50.24 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.577 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 64.31 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 71.32 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.528 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 54.2 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.428 HG21 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 64.02 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 60.31 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 31.24 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 60.23 112.147 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 73.04 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.58 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 54.22 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 73.2 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 61.32 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 62.3 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 71.22 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 73.25 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.512 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.21 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.455 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 71.13 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.76 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 52.22 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 72.55 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' B' ' 20' ' ' THR . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 65.4 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 54.4 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.504 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 15.41 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.504 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 73.23 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 72.23 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 64.31 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 42.12 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.636 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 72.11 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.465 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 71.32 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.426 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.466 HD12 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 65.34 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 64.34 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.466 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 51.55 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 54.41 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 74.52 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 72.04 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 60.3 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.488 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 73.43 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.516 HG13 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 65.32 109.815 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 53.42 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 62.14 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.448 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 42.42 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.606 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 70.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 72.22 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.448 HD21 ' HE3' ' B' ' 129' ' ' LYS . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.606 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 62.33 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.48 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 133' ' ' LEU . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 72.41 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 71.24 112.116 -177.891 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 . . . . . 0 N--CA 1.488 1.432 0 N-CA-C 112.127 0.417 . . . . 74.54 112.127 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 64.43 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 63.21 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 74.31 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 72.25 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 72.43 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 61.45 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 51.5 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 63.34 111.509 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.615 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.427 ' HB ' HD12 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 73.13 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 73.41 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.522 ' O ' HG23 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 51.3 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 71.14 112.401 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 HD21 ' A' ' 68' ' ' LEU . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 74.13 111.748 174.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 64.22 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.431 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 72.24 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 73.31 112.625 174.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.12 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 72.34 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 54.23 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 74.43 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 70.5 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 53.0 113.398 -177.83 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp . . . . . 0 CA--C 1.557 1.226 0 N-CA-C 112.015 0.376 . . . . 71.23 112.015 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 65.41 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 55.22 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.467 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 52.03 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 34.04 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 74.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 74.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.43 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 71.25 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 34.32 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 63.03 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 73' ' ' HIS . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 52.11 111.786 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.11 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.23 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HG ' HG21 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 71.13 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.608 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.499 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 71.32 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.32 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.02 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 42.33 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 62.32 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 74.43 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.439 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 63.44 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.549 HG23 HD22 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 63.32 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.426 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 33.21 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.444 ' HA ' HD12 ' A' ' 107' ' ' ILE . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 62.22 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.549 HD22 HG23 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.11 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 61.44 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.483 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 72.11 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 64.33 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 73.23 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 44.41 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.453 HG13 HD11 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 62.11 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.41 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 54.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.532 HD13 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.549 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 42.54 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 63.34 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.649 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 45.45 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt . . . . . 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 . . . . . 0 CA--C 1.563 1.456 0 CA-C-O 122.023 0.916 . . . . 63.54 110.969 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.404 ' SG ' ' CE1' ' B' ' 73' ' ' HIS . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 73.23 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.613 ' HB3' HD11 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 65.25 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 61.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 50.45 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.613 HD11 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.724 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 51.11 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.479 HD11 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 71.51 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.561 ' HD3' HG22 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 60.45 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 74.42 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 71.5 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 61.54 110.779 171.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.4 ' OE1' HD13 ' B' ' 118' ' ' LEU . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 60.21 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.597 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 61.23 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 71.24 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 70.21 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 51.55 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 54.02 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.425 ' HA ' ' HB2' ' B' ' 50' ' ' SER . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.504 HG21 HD13 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 70.42 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 73.21 112.062 -177.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.554 1.112 0 CA-C-O 120.654 0.264 . . . . 64.42 111.657 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.607 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 63.2 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 72.25 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 50.24 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.561 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 64.31 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.504 HD13 HG21 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 71.32 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 54.2 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 64.02 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 60.31 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 31.24 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 60.23 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.459 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 73.04 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.481 HG23 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 54.22 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 73.2 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 61.32 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 62.3 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 71.22 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 73.25 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.663 ' HB3' HD23 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.21 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 71.13 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.724 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 52.22 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.447 ' HA ' HG22 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 72.55 112.905 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 65.4 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.583 HG23 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 54.4 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.583 HG23 HG23 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 15.41 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 73.23 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 72.23 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 64.31 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . 0.491 ' HB3' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 42.12 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 72.11 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.491 HG23 ' HB3' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.407 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 71.32 114.415 173.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.628 HD12 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 65.34 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 64.34 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.63 ' HA ' HD12 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 51.55 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 54.41 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.628 HD13 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 74.52 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 72.04 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 60.3 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.536 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 73.43 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 65.32 110.419 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 53.42 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 62.14 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 42.42 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 70.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 72.22 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 71.32 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 62.33 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 72.41 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? . . . . . 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 71.24 110.274 169.625 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.49 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 64.43 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.454 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 63.21 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 74.31 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 72.25 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 72.43 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 61.45 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 51.5 111.13 176.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.462 HD23 HD12 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 63.34 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.633 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG11 HD21 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 73.13 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.426 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 73.41 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.704 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 51.3 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.447 ' HB2' HD22 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 71.14 110.275 177.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 74.13 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 64.22 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 73.31 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.12 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 72.34 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 54.23 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 74.43 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 70.5 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 53.0 110.59 168.268 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt . . . . . 0 CA--C 1.55 0.955 0 N-CA-C 112.3 0.481 . . . . 71.23 112.3 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 65.41 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.704 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 55.22 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.633 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 52.03 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 34.04 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 74.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.544 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 74.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.476 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.43 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.544 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 71.25 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 34.32 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 63.03 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 52.11 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.476 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.11 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.23 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.406 ' HG2' ' HB3' ' A' ' 99' ' ' PRO . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 71.13 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 71.32 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.517 ' HD3' HD13 ' A' ' 90' ' ' LEU . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.32 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.02 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 42.33 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.406 ' HB3' ' HG2' ' A' ' 84' ' ' GLU . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 62.32 115.235 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 74.43 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.421 ' O ' HG12 ' A' ' 107' ' ' ILE . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.481 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 63.44 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 63.32 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 33.21 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 107' ' ' ILE . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 62.22 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD12 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.11 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 61.44 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 72.11 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.455 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 64.33 109.935 176.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 73.23 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 44.41 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 62.11 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.647 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.41 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 54.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.47 HD11 HG13 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.647 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 42.54 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.607 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 63.34 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 45.45 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 . . . . . 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.417 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.447 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 73.23 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . 0.44 HG11 HG22 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 65.25 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.723 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 61.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 50.45 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.521 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.555 HG11 HD21 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 51.11 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 71.51 109.405 172.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.491 ' HB3' HD11 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 60.45 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 74.42 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.472 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 71.5 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 61.54 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 60.21 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 61.23 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 71.24 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 70.21 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 51.55 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.576 ' HA ' HE21 ' B' ' 47' ' ' GLN . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 54.02 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.586 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.576 HE21 ' HA ' ' B' ' 44' ' ' ASP . 29.3 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.484 HG22 ' O ' ' B' ' 44' ' ' ASP . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 70.42 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m . . . . . 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 73.21 111.587 172.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.428 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt . . . . . 0 CA--C 1.558 1.268 0 N-CA-C 112.529 0.566 . . . . 64.42 112.529 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.537 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 63.2 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 72.25 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.428 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 50.24 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 64.31 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.439 HG23 HG12 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HB2' HG11 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 71.32 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.447 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 54.2 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' B' ' 64' ' ' LEU . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 64.02 110.762 174.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.472 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 60.31 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 31.24 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 60.23 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.56 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 73.04 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 54.22 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 73.2 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 61.32 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 62.3 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 71.22 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 73.25 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.697 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.21 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.495 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 71.13 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.697 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 52.22 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.465 ' CZ ' HG21 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 72.55 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 65.4 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.723 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 54.4 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.642 HG23 HG23 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 15.41 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 73.23 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 72.23 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.689 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 64.31 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 42.12 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.689 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 72.11 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.427 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 71.32 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.638 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.505 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.638 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 65.34 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 64.34 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 51.55 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.442 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 54.41 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 74.52 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 72.04 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 60.3 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.512 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 73.43 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.512 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 65.32 110.187 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 53.42 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 62.14 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 42.42 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.7 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 70.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.508 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 72.22 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.513 HD13 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 71.32 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.533 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 62.33 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 72.41 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm . . . . . 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 71.24 111.944 -173.762 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 . . . . . 0 CA--C 1.562 1.42 0 N-CA-C 112.379 0.511 . . . . 74.54 112.379 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 64.43 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 63.21 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 74.31 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 72.25 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 72.43 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 61.45 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 51.5 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 63.34 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.721 HG11 HD21 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 73.13 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.564 HD13 HD11 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 73.41 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.645 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.548 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 51.3 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 71.14 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 74.13 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.424 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 64.22 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 72.24 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 73.31 112.288 173.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.783 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.12 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 72.34 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.424 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 54.23 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.623 ' HB2' HD13 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 74.43 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.783 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 70.5 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 53.0 110.398 170.049 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 112.168 0.433 . . . . 71.23 112.168 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 65.41 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.645 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 55.22 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 52.03 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 34.04 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.607 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 74.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.623 HD13 ' HB2' ' A' ' 44' ' ' ASP . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 74.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.43 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 71.25 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 34.32 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.481 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 63.03 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.432 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 52.11 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.454 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.543 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.11 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.23 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.69 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 71.13 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.721 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.543 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 71.32 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HB3' ' HE2' ' A' ' 93' ' ' LYS . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.32 112.337 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.02 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 42.33 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.486 ' H ' ' HD2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 62.32 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 74.43 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.571 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.481 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 63.44 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 63.32 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 33.21 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 62.22 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.571 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.11 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.481 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 61.44 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.69 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 72.11 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 64.33 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 73.23 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 44.41 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 62.11 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.73 ' HA ' HG22 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.41 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 54.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.73 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 42.54 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.494 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 63.34 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 45.45 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' HD23 ' B' ' 137' ' ' LEU . 43.3 mtpt . . . . . 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 29.4 t70 . . . . . 0 CA--C 1.55 0.976 0 CA-C-O 121.432 0.634 . . . . 63.54 111.221 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 73.23 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.428 HD23 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 65.25 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 61.41 111.998 -173.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 50.45 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.575 ' HA ' HD13 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.549 HG22 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.638 HG11 HD21 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 51.11 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.575 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 71.51 109.713 175.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 60.45 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 74.42 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 71.5 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 61.54 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' B' ' 118' ' ' LEU . 13.9 mm100 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 60.21 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 61.23 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 71.24 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 70.21 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 51.55 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.624 ' HB3' HD13 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 54.02 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.543 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD11 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 70.42 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 73.21 111.412 177.685 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.984 0.421 . . . . 64.42 111.856 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 63.2 114.086 -178.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 72.25 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 50.24 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 64.31 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 71.32 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 54.2 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . 0.405 ' HA ' ' HG3' ' B' ' 69' ' ' GLN . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 64.02 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 60.31 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' B' ' 66' ' ' ASP . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 31.24 113.468 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . 0.463 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 60.23 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 73.04 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 54.22 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 73.2 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.589 ' HB2' HD13 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 61.32 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' B' ' 87' ' ' TYR . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 62.3 111.554 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 71.22 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 73.25 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.528 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.21 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.639 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 71.13 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.639 HD22 ' HG3' ' B' ' 89' ' ' GLN . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 52.22 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 72.55 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 65.4 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.431 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 54.4 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 15.41 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 73.23 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.701 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 72.23 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 64.31 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 42.12 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.69 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 72.11 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' B' ' 115' ' ' LEU . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 71.32 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.541 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.493 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 65.34 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 64.34 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.483 ' HA ' HD12 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 51.55 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 54.41 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.541 HD13 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 74.52 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 72.04 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 60.3 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.545 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 73.43 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.4 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 65.32 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 53.42 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 62.14 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' B' ' 124' ' ' MET . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 42.42 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 70.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 72.22 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.665 HD13 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 71.32 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 62.33 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.523 ' HB2' HD11 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.494 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 72.41 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? . . . . . 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 71.24 111.583 172.375 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 . . . . . 0 N--CA 1.492 1.644 0 N-CA-C 112.803 0.668 . . . . 74.54 112.803 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 64.43 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.481 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 63.21 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 74.31 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 72.25 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 72.43 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 61.45 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 51.5 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.487 HD23 HD12 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 63.34 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.681 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.52 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.57 HG11 HD21 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 73.13 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD11 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 73.41 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 27' ' ' PRO . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 51.3 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 71.14 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.461 HD13 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 74.13 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.443 ' HG2' HD22 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 64.22 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.622 ' NE2' HD13 ' A' ' 118' ' ' LEU . 18.1 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 72.24 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.431 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 73.31 114.036 173.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.12 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 72.34 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 54.23 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 74.43 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.407 ' H ' HD21 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 70.5 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m . . . . . 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 53.0 111.108 170.615 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt . . . . . 0 CA--C 1.564 1.5 0 N-CA-C 112.149 0.426 . . . . 71.23 112.149 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 61' ' ' VAL . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 65.41 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 55.22 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.681 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 52.03 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 34.04 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.545 HD22 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 74.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 74.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.43 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 71.25 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 34.32 110.983 172.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 63.03 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 52.11 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.11 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.23 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 71.13 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.57 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 71.32 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.32 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.02 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 42.33 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 62.32 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 74.43 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 63.44 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.743 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 63.32 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 33.21 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.419 ' HA ' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 62.22 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.743 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.44 HG21 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.447 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.11 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.622 HD13 ' NE2' ' A' ' 36' ' ' GLN . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 61.44 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 72.11 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.507 HG13 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.486 ' O ' ' HD3' ' A' ' 128' ' ' LYS . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 64.33 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 73.23 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 44.41 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.526 HG13 HD11 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 62.11 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.482 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.41 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 54.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 42.54 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 63.34 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 45.45 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt . . . . . 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.478 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 73.23 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 65.25 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.525 ' NH2' HE22 ' B' ' 69' ' ' GLN . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 61.41 112.011 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 50.45 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.606 ' HA ' HD13 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.582 HG22 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.659 HG11 HD21 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 51.11 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.606 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 71.51 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.693 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.482 ' HB3' HD11 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 60.45 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.601 HG22 HD11 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 74.42 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 71.5 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 61.54 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD11 ' B' ' 118' ' ' LEU . 0.0 OUTLIER -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 60.21 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.448 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 61.23 112.851 175.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.659 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 71.24 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 70.21 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 51.55 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 54.02 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.659 ' HB3' HD21 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.59 HG22 HG23 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 70.42 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 73.21 109.492 161.208 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.403 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 27.2 pt . . . . . 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 64.42 113.562 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 63.2 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.488 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 72.25 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 50.24 110.943 176.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.52 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.693 HG22 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 64.31 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.59 HG23 HG22 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.418 HD11 HD12 ' B' ' 40' ' ' LEU . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 71.32 111.009 173.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.478 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 54.2 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 64.02 110.693 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.462 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 60.31 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.525 HE22 ' NH2' ' B' ' 18' ' ' ARG . 65.1 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 31.24 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.563 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 60.23 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 73.04 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 54.22 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 73.2 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 61.32 109.868 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 62.3 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.543 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 71.22 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 73.25 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.562 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.21 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.407 ' HG3' HD22 ' B' ' 90' ' ' LEU . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 71.13 111.779 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.659 HD21 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 52.22 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.442 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 72.55 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 65.4 112.488 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 54.4 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 15.41 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' B' ' 92' ' ' LYS . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 73.23 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 72.23 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.415 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 64.31 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 42.12 111.305 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.447 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 72.11 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.543 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 71.32 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.44 HD11 HG21 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 65.34 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 64.34 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 51.55 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 54.41 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 74.52 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.488 HG21 HD11 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 72.04 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.555 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 60.3 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.4 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 73.43 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.452 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 65.32 109.48 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 53.42 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 62.14 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.482 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 42.42 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 70.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 72.22 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.526 HD11 HG13 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 71.32 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 62.33 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.557 ' HB2' HD11 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 72.41 108.331 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt . . . . . 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 71.24 111.784 178.502 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 112.102 0.408 . . . . 74.54 112.102 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 64.43 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 63.21 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 74.31 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 72.25 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 72.43 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.475 ' HB2' HG12 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 61.45 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 51.5 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.504 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 63.34 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 73.13 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.464 HD11 HD22 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 73.41 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 27' ' ' PRO . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 51.3 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 71.14 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 74.13 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 64.22 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 72.24 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 73.31 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.12 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 72.34 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 54.23 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.62 ' HB2' HD13 ' A' ' 67' ' ' ILE . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 74.43 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.758 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 70.5 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.608 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.462 HG22 HG23 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 53.0 109.12 166.904 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.49 1.534 0 CA-C-O 120.237 0.065 . . . . 71.23 111.007 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.655 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 65.41 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 55.22 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.486 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 52.03 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 34.04 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.462 HG23 HG22 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 74.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.62 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 74.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.43 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 71.25 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 34.32 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 63.03 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' HD12 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 52.11 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.466 ' HB2' HD13 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.11 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.23 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.404 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 71.13 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.504 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 71.32 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.32 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.475 HG12 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.02 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 42.33 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 62.32 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 74.43 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.532 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 63.44 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 63.32 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.536 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 33.21 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 62.22 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.11 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 61.44 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 72.11 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 64.33 110.88 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 73.23 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 44.41 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 62.11 111.667 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.466 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.41 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 54.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.466 HG22 ' HA ' ' A' ' 131' ' ' GLN . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 42.54 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 63.34 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.675 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 45.45 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm . . . . . 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 . . . . . 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 73.23 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 65.25 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 61.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 50.45 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.571 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.75 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 51.11 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 71.51 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.733 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 60.45 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 74.42 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 71.5 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.568 ' HD3' HD22 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 61.54 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 60.21 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 61.23 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 71.24 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 70.21 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 51.55 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 54.02 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.598 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 70.42 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 73.21 108.84 163.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 64.42 112.273 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 63.2 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.415 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 72.25 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 50.24 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.733 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 64.31 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 71.32 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 54.2 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 64.02 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 60.31 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 31.24 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.496 ' HB3' HG12 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 60.23 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 73.04 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 54.22 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 73.2 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 61.32 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 62.3 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.401 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 71.22 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 73.25 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.662 ' HB3' HD23 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.21 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 71.13 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.75 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 52.22 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.504 ' HA ' HG22 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 72.55 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 65.4 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.526 HG23 HG23 ' B' ' 95' ' ' THR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 54.4 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.526 HG23 HG23 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 15.41 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 73.23 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 72.23 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 64.31 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 42.12 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 72.11 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.541 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 71.32 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.474 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.541 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 65.34 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 64.34 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' B' ' 106' ' ' ILE . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 51.55 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 54.41 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.436 HD21 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 74.52 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 72.04 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 60.3 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.535 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 73.43 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 65.32 109.811 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 53.42 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 62.14 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.539 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 42.42 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.612 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.5 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 70.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 72.22 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 71.32 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.612 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 62.33 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 72.41 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? . . . . . 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 71.24 111.892 178.827 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 . . . . . 0 CA--C 1.557 1.221 0 N-CA-C 112.215 0.45 . . . . 74.54 112.215 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 64.43 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.401 ' HB3' ' CG ' ' A' ' 76' ' ' TYR . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 63.21 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 74.31 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 72.25 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 72.43 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.513 ' HD2' HD13 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 61.45 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 51.5 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.557 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 63.34 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.444 HG22 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 73.13 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 73.41 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 51.3 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 71.14 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 74.13 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 64.22 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 72.24 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 73.31 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.401 HD11 HG22 ' A' ' 31' ' ' THR . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.12 110.476 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 72.34 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 54.23 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 74.43 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 70.5 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m . . . . . 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 53.0 112.87 174.191 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 71.23 114.142 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 65.41 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 55.22 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 52.03 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 34.04 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 74.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 74.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.43 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 71.25 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 34.32 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 63.03 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 52.11 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.557 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.11 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.23 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.411 ' HB3' HD23 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 71.13 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.423 ' HG3' HD22 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 71.32 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.32 112.862 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 21' ' ' LEU . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.02 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 42.33 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 62.32 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 74.43 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 63.44 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 63.32 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 33.21 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 62.22 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.11 111.666 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 61.44 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 72.11 113.021 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 64.33 110.155 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 73.23 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 44.41 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.488 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 62.11 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.59 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.41 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.528 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 54.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.59 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 42.54 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 63.34 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 45.45 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? . . . . . 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.444 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 73.23 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 65.25 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 61.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 50.45 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.461 HG21 HD11 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 51.11 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 71.51 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.578 ' HD3' HG22 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 60.45 112.111 -170.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.582 HG22 HD11 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 74.42 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . 0.413 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.455 HD13 HD11 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 71.5 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 61.54 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 60.21 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.573 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 61.23 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.817 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 71.24 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 70.21 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 51.55 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.598 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 54.02 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.817 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.534 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.6 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.533 HG22 HG23 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 70.42 111.779 177.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t . . . . . 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 73.21 112.968 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.437 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt . . . . . 0 CA--C 1.559 1.325 0 N-CA-C 112.7 0.63 . . . . 64.42 112.7 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 63.2 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.504 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 72.25 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 50.24 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.578 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 64.31 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.533 HG23 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 71.32 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 54.2 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.598 HG21 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 64.02 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.455 HD11 HD13 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 60.31 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 31.24 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . 0.469 ' O ' HG23 ' B' ' 77' ' ' VAL . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 60.23 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.464 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 73.04 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.469 HG23 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 54.22 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 73.2 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 61.32 110.673 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.617 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 62.3 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.512 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 71.22 110.331 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 73.25 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.617 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.21 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 71.13 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 52.22 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 72.55 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 65.4 112.03 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 54.4 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 15.41 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 73.23 111.611 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 72.23 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 64.31 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 42.12 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.512 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 72.11 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.505 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 71.32 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.532 HD12 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 65.34 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 64.34 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.532 ' HG3' HD12 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 51.55 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 54.41 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 74.52 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.441 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 72.04 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 60.3 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.457 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . 0.441 HG22 ' O ' ' B' ' 117' ' ' GLN . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 73.43 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.457 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 65.32 110.151 176.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 53.42 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 62.14 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.532 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 42.42 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.629 ' HA ' HG22 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 70.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 72.22 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.566 HD13 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 71.32 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.629 HG22 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 62.33 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 72.41 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 47.8 tttm . . . . . 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 71.24 110.32 178.523 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 . . . . . 0 N--CA 1.485 1.296 0 N-CA-C 111.675 0.25 . . . . 74.54 111.675 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 64.43 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 63.21 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 74.31 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 72.25 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 72.43 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 61.45 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 51.5 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 63.34 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 73.13 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.405 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 73.41 110.644 -174.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.56 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.578 ' HB3' HD22 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' PRO . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 51.3 113.816 178.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 71.14 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 74.13 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 64.22 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.446 ' HG3' HD11 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 72.24 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 73.31 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.12 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 72.34 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 54.23 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 74.43 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 70.5 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 HG23 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 53.0 112.879 179.19 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 42.0 pt . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 112.447 0.536 . . . . 71.23 112.447 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 65.41 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 55.22 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 52.03 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 34.04 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.524 HG23 HG22 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 74.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.569 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 74.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.653 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 71.25 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 34.32 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.487 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 63.03 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 52.11 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.653 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.11 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.42 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.23 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.789 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.42 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' HD23 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 71.13 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.655 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 71.32 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.32 112.881 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.02 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 42.33 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 62.32 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.789 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 74.43 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.531 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.481 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 63.44 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.482 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 63.32 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.599 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 33.21 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.599 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 62.22 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.482 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.11 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.446 HD11 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 61.44 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 72.11 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.576 ' HG2' HD21 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 64.33 110.0 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 73.23 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 44.41 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 62.11 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.628 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.41 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 54.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 42.54 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.6 ' HB2' HD11 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 63.34 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 45.45 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' B' ' 140' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.56 1.365 0 CA-C-O 121.052 0.454 . . . . 63.54 112.117 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.523 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 73.23 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . 0.439 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 65.25 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.523 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 61.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 50.45 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.585 HD23 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.61 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.46 HG11 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 51.11 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.401 ' HA ' ' CE1' ' B' ' 87' ' ' TYR . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.509 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 71.51 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.53 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 60.45 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.597 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 74.42 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.446 ' HB2' HD13 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 71.5 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 61.54 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' HD11 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 60.21 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 61.23 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.567 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 71.24 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 70.21 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 51.55 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.729 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 54.02 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.626 ' HB3' HD21 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.63 HG22 HG23 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 70.42 111.522 173.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t . . . . . 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 73.21 111.829 177.949 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.438 HD12 ' HD2' ' B' ' 59' ' ' ARG . 18.8 pt . . . . . 0 CA--C 1.564 1.502 0 N-CA-C 112.61 0.596 . . . . 64.42 112.61 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.614 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 63.2 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.451 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 72.25 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 50.24 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.614 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.61 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 64.31 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.63 HG23 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 71.32 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 54.2 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.729 HG21 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 64.02 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 60.31 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.641 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 31.24 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.641 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 60.23 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 73.04 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 54.22 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 73.2 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 61.32 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 62.3 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.502 HD21 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 71.22 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 73.25 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.21 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.434 ' HG3' HD22 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 71.13 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.585 HD12 HD23 ' B' ' 21' ' ' LEU . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 52.22 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 72.55 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 65.4 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 54.4 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 15.41 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 73.23 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 72.23 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 64.31 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 42.12 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 72.11 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 107' ' ' ILE . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 71.32 113.062 177.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.402 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.41 ' O ' HD13 ' B' ' 106' ' ' ILE . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 65.34 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 64.34 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 51.55 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 54.41 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 74.52 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 72.04 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 60.3 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.674 ' SD ' HD21 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.502 ' HG2' HD21 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 73.43 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.521 HG22 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 65.32 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 53.42 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 62.14 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 42.42 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 70.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 72.22 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 71.32 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.496 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 62.33 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 72.41 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.441 ' HD3' ' HG3' ' A' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 71.24 111.073 175.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.439 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 112.853 0.686 . . . . 74.54 112.853 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 64.43 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 63.21 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 74.31 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 72.25 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 72.43 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 61.45 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 51.5 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 63.34 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.597 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 73.13 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 73.41 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD3' HG22 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.7 HD11 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.62 HG22 HD11 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 51.3 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 71.14 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 74.13 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 64.22 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 72.24 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 73.31 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.431 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG22 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.12 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 72.34 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 54.23 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.603 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 74.43 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 70.5 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.658 ' NE2' HG13 ' A' ' 48' ' ' VAL . 1.5 pp0? -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.667 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t . . . . . 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 53.0 111.974 178.005 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt . . . . . 0 CA--C 1.562 1.436 0 N-CA-C 112.958 0.725 . . . . 71.23 112.958 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 65.41 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 55.22 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 52.03 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 34.04 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.7 HD21 HD11 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 74.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 74.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.43 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 71.25 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 75' ' ' GLY . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 34.32 111.107 173.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.439 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.463 ' H ' HG23 ' A' ' 71' ' ' THR . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.482 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 63.03 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 52.11 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.11 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.23 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 71.13 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.546 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 71.32 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.32 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.571 HG23 HG23 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.02 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.571 HG23 HG23 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 42.33 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.546 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.628 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 62.32 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 74.43 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.431 ' O ' HD13 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 63.44 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.4 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 63.32 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.694 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 33.21 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.694 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 62.22 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.11 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 61.44 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 72.11 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 64.33 110.108 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 73.23 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 44.41 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 62.11 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.41 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 54.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.646 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 42.54 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.722 ' HB2' HD11 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 63.34 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 45.45 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm . . . . . 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 . . . . . 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 73.23 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.598 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 65.25 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.598 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 61.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 50.45 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.406 ' HB ' HD12 ' B' ' 25' ' ' ILE . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 51.11 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.652 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 71.51 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.822 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 60.45 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 74.42 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 71.5 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 61.54 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 60.21 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 61.23 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 71.24 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 70.21 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 51.55 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.498 ' O ' HG22 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 54.02 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.56 ' HB3' HD21 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 70.42 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 73.21 112.643 -176.176 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 37.9 pt . . . . . 0 CA--C 1.554 1.11 0 N-CA-C 112.634 0.605 . . . . 64.42 112.634 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.542 ' O ' HG23 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 63.2 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 72.25 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 50.24 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' B' ' 48' ' ' VAL . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.822 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 64.31 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.429 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' B' ' 67' ' ' ILE . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 71.32 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 54.2 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 64.02 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 60.31 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.509 HG21 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 31.24 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 60.23 111.524 175.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 73.04 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 54.22 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 73.2 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . 0.473 ' O ' HD13 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 61.32 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.652 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 62.3 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.532 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 71.22 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . 0.434 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 73.25 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.485 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.21 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 71.13 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 52.22 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.601 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 72.55 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HD3' HD13 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 65.4 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.438 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 54.4 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 15.41 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 73.23 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 72.23 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.601 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 64.31 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 42.12 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 72.11 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.491 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 71.32 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.555 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 65.34 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 64.34 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 51.55 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 54.41 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.555 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 74.52 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 72.04 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 60.3 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 73.43 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.436 ' HE2' ' HB2' ' B' ' 124' ' ' MET . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 65.32 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 53.42 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 62.14 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.602 ' HA ' HE21 ' B' ' 131' ' ' GLN . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 42.42 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.602 HE21 ' HA ' ' B' ' 128' ' ' LYS . 27.5 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 70.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 72.22 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 71.32 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.534 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 62.33 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.632 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.722 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 72.41 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm . . . . . 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 71.24 112.524 -170.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 . . . . . 0 CA--C 1.554 1.131 0 CA-C-O 120.145 0.021 . . . . 74.54 111.01 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 64.43 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.419 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 63.21 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 74.31 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 72.25 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 72.43 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 61.45 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 51.5 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 63.34 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.595 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 73.13 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.402 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 73.41 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.742 ' HA ' HG12 ' A' ' 30' ' ' ILE . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.656 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 51.3 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.417 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 71.14 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.429 HD13 HD11 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 74.13 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 64.22 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 72.24 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 73.31 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.551 HG12 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.656 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.12 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 72.34 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 54.23 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 74.43 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 70.5 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 53.0 110.487 165.946 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.487 1.385 0 N-CA-C 112.569 0.581 . . . . 71.23 112.569 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.537 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 65.41 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.702 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 55.22 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.735 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 52.03 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 34.04 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.429 HD11 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 74.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 74.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.43 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 71.25 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 34.32 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.472 ' O ' HG23 ' A' ' 77' ' ' VAL . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.551 ' HG2' HG12 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 63.03 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 52.11 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.11 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . 0.404 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.23 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.404 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.538 ' HB3' HD23 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 71.13 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 71.32 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.49 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.32 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.02 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 42.33 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 62.32 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 74.43 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.444 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 63.44 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 63.32 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 33.21 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 62.22 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.476 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.11 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 61.44 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 72.11 111.831 178.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 64.33 110.24 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 73.23 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 44.41 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.446 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 62.11 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.2 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.41 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 54.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 42.54 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.614 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 63.34 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.556 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 45.45 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 73.23 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 65.25 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 61.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 50.45 111.104 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.625 HD23 HD12 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.441 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.771 HG11 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 51.11 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 71.51 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 60.45 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.478 ' HA ' HD12 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 74.42 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 71.5 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 61.54 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.43 ' HG3' HD21 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 60.21 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.617 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 61.23 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.438 HD12 HD21 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 71.24 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 70.21 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 51.55 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 47' ' ' GLN . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 54.02 111.912 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 44' ' ' ASP . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 70.42 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p . . . . . 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 73.21 109.525 168.652 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.542 HD12 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp . . . . . 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 64.42 113.61 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 63.2 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 72.25 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 50.24 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.562 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.492 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 64.31 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 71.32 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 54.2 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 64.02 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.446 HD21 HD13 ' B' ' 34' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 60.31 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 31.24 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 60.23 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 73.04 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 54.22 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 73.2 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 61.32 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 62.3 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 71.22 110.463 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 73.25 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . 0.466 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.21 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.558 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 71.13 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.771 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 52.22 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.511 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 72.55 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 65.4 112.842 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 54.4 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 15.41 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 73.23 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 72.23 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.511 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 64.31 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 42.12 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.425 ' HD2' ' HB2' ' B' ' 99' ' ' PRO . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 72.11 110.858 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 71.32 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.444 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 65.34 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 64.34 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 51.55 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 54.41 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 74.52 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 72.04 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.43 HD21 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 60.3 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.518 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 73.43 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.518 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 65.32 110.736 -176.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 53.42 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 62.14 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 42.42 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.627 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.6 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 70.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 72.22 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 71.32 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.627 HG22 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 62.33 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 72.41 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? . . . . . 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 71.24 111.46 -174.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 112.6 0.593 . . . . 74.54 112.6 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 64.43 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 63.21 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 74.31 111.022 172.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 72.25 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 72.43 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 61.45 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 51.5 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 25' ' ' ILE . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 63.34 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.553 HG11 HD21 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 73.13 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 73.41 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.466 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.743 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.466 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 51.3 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 71.14 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.471 HD13 HD11 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 74.13 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 64.22 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HG3' HD11 ' A' ' 118' ' ' LEU . 14.9 mm100 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 72.24 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 73.31 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.12 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 72.34 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 54.23 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 74.43 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 70.5 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t . . . . . 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 53.0 112.798 -175.961 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.453 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp . . . . . 0 CA--C 1.564 1.499 0 N-CA-C 113.556 0.947 . . . . 71.23 113.556 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 65.41 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 55.22 111.433 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.743 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 52.03 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 34.04 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 74.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 74.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.43 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 71.25 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 34.32 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 63.03 112.706 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.436 ' HA ' HD12 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 52.11 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.495 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.11 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.23 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 71.13 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 71.32 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.32 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 90' ' ' LEU . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.02 112.618 175.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 42.33 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 98' ' ' GLU . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 62.32 109.869 162.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 74.43 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.495 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 63.44 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 63.32 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.406 HG23 ' HG3' ' A' ' 112' ' ' GLU . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 33.21 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.406 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 62.22 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.11 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.569 HD11 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 61.44 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 72.11 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 64.33 110.552 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 73.23 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 44.41 110.931 173.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 62.11 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.555 ' HA ' HG22 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.41 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 54.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 42.54 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 63.34 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 45.45 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm . . . . . 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 . . . . . 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 73.23 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 65.25 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.473 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 61.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 50.45 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.61 HD23 HD12 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.447 HG11 HD21 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 51.11 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.508 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 71.51 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.582 ' HB3' HD22 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 60.45 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 74.42 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 71.5 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 61.54 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 60.21 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 61.23 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 71.24 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 70.21 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 51.55 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 54.02 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 70.42 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t . . . . . 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 73.21 111.769 170.774 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.403 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.2 pp . . . . . 0 CA--C 1.558 1.251 0 N-CA-C 112.352 0.501 . . . . 64.42 112.352 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 63.2 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 72.25 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 50.24 111.94 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.445 ' HB3' HG13 ' B' ' 48' ' ' VAL . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 64.31 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 71.32 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 54.2 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 64.02 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 60.31 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 31.24 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 60.23 111.448 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.455 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 73.04 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.479 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 54.22 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 73.2 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 61.32 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 62.3 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 71.22 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 73.25 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.41 ' HB3' HD23 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.21 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 71.13 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.61 HD12 HD23 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 52.22 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 72.55 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.585 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 65.4 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 54.4 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 15.41 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 73.23 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 72.23 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.406 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 64.31 113.251 170.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 42.12 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 72.11 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.469 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 71.32 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . 0.479 ' HG2' HG12 ' B' ' 77' ' ' VAL . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 65.34 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 64.34 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' B' ' 36' ' ' GLN . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.404 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 51.55 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 54.41 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 74.52 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 72.04 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 60.3 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.481 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 73.43 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.481 HG22 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.4 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 65.32 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 53.42 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 62.14 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 42.42 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' B' ' 134' ' ' THR . 22.7 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 70.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 72.22 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 71.32 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 62.33 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 72.41 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm . . . . . 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 71.24 111.565 -171.921 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 . . . . . 0 CA--C 1.562 1.433 0 N-CA-C 113.655 0.983 . . . . 74.54 113.655 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 64.43 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 63.21 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 74.31 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 72.25 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 72.43 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 61.45 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 51.5 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.473 HD23 HD12 ' A' ' 90' ' ' LEU . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 63.34 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.711 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.657 HG11 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 73.13 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 73.41 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 51.3 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 71.14 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 74.13 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 64.22 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 110' ' ' SER . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 72.24 112.002 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 73.31 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.12 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 72.34 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 54.23 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.402 ' O ' HG22 ' A' ' 48' ' ' VAL . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 74.43 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.437 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 70.5 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.676 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.494 HD21 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 53.0 110.885 171.771 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 71.23 113.108 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.711 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 65.41 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 55.22 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 34.04 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 74.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 74.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.581 HD13 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.43 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 71.25 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 34.32 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 63.03 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 52.11 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HB2' HD13 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.11 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.23 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 71.13 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.447 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.54 ' HG3' HD22 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.657 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.564 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.586 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 71.32 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.484 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.32 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.44 HG22 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.02 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 42.33 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.586 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 62.32 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.416 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 74.43 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 63.44 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 63.32 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 103' ' ' PHE . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 33.21 112.614 -176.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.51 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 62.22 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.477 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.11 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 61.44 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.493 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 72.11 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 64.33 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 73.23 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 44.41 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 62.11 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.617 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.41 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 54.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.617 HG22 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 42.54 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 63.34 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.603 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 45.45 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.764 0.653 . . . . 63.54 112.764 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.405 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 73.23 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.406 HD23 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 65.25 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.411 ' O ' HG23 ' B' ' 22' ' ' THR . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 61.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 50.45 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.51 HD23 HD12 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.488 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.78 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.451 HG11 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 51.11 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 71.51 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.586 ' HD3' HG22 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.512 ' HB2' HD11 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 60.45 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.55 HG23 ' O ' ' B' ' 27' ' ' PRO . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 74.42 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 71.5 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 61.54 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 60.21 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 61.23 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 74' ' ' LYS . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 71.24 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 70.21 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 51.55 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.514 ' O ' HG22 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 54.02 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.612 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 70.42 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 73.21 112.372 178.628 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt . . . . . 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 64.42 113.518 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.491 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 63.2 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 72.25 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 50.24 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.612 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.586 HG22 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 64.31 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 71.32 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 54.2 110.339 174.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 64.02 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 60.31 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 31.24 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.401 ' HB3' HG12 ' B' ' 39' ' ' VAL . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 60.23 111.101 174.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 73.04 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.501 ' HA ' HD12 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 54.22 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' B' ' 105' ' ' MET . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 73.2 112.639 177.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 61.32 109.3 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 62.3 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 71.22 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 73.25 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.447 ' HB3' HD23 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.21 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.458 ' HG3' HD22 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 71.13 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.58 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 52.22 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 72.55 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 65.4 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.507 HG23 HG23 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 54.4 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.507 HG23 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 15.41 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 73.23 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 72.23 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 64.31 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 42.12 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 72.11 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 71.32 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . 0.401 ' HG2' ' HB2' ' B' ' 78' ' ' ALA . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.537 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 65.34 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 64.34 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.537 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 51.55 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 54.41 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 74.52 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 72.04 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 60.3 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.4 ' O ' HG13 ' B' ' 123' ' ' VAL . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 73.43 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 119' ' ' LEU . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 65.32 110.958 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 53.42 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 62.14 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' B' ' 126' ' ' LEU . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 42.42 111.314 173.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 126' ' ' LEU . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 70.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 72.22 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 71.32 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 62.33 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.603 ' HB2' HD11 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 72.41 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt . . . . . 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 71.24 111.538 -176.152 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 111.638 0.236 . . . . 74.54 111.638 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 64.43 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 63.21 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 74.31 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 72.25 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.408 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 72.43 112.893 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.535 ' HG2' HD13 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 61.45 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 51.5 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.482 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 63.34 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.566 HG11 HD21 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 73.13 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 73.41 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.732 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.565 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.554 HG22 HD11 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 51.3 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 71.14 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.486 HD13 HD21 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 74.13 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 64.22 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HG3' HD11 ' A' ' 118' ' ' LEU . 14.3 mm100 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 72.24 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.544 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 73.31 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.51 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.554 HD11 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.12 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 72.34 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 54.23 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 74.43 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 70.5 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t . . . . . 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 53.0 111.049 176.017 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 111.751 0.278 . . . . 71.23 111.751 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.732 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 65.41 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 55.22 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.565 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 52.03 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 34.04 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.449 HD11 HD12 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.535 HD13 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 74.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 74.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.486 HD21 HD13 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.43 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 71.25 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 34.32 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.51 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 63.03 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.498 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 52.11 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.11 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.497 HD23 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.23 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.584 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.418 ' HB3' HD23 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 71.13 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.621 HD13 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 71.32 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.621 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.32 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.02 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.406 HG23 HG23 ' A' ' 94' ' ' VAL . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 42.33 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 62.32 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.584 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 74.43 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 63.44 111.233 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 63.32 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.544 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 33.21 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 62.22 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.11 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 61.44 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 72.11 113.039 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 64.33 110.63 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' B' ' 126' ' ' LEU . 9.7 tp-100 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 73.23 111.321 176.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 44.41 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 62.11 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.41 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 54.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.494 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 42.54 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.592 ' HB2' HD11 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 63.34 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 45.45 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.409 ' HD2' HD23 ' B' ' 137' ' ' LEU . 63.9 tttm . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . 0.466 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 73.23 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 65.25 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 61.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 50.45 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.573 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.405 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.577 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.676 HG11 HD21 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 51.11 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 HD11 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 71.51 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.664 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . 0.502 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 60.45 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 74.42 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' B' ' 40' ' ' LEU . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 71.5 112.113 176.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 61.54 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 60.21 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 61.23 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.515 HD11 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 71.24 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 70.21 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 51.55 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 54.02 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 70.42 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 73.21 111.064 173.113 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp . . . . . 0 CA--C 1.56 1.353 0 CA-C-O 121.364 0.602 . . . . 64.42 111.175 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 63.2 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.577 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 72.25 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 50.24 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.58 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.664 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 64.31 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.472 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 71.32 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.466 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 54.2 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 64.02 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.436 HD21 HD12 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 60.31 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.593 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 31.24 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.593 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 60.23 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 73.04 111.565 173.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 54.22 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 73.2 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 61.32 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.5 HD11 HD13 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 62.3 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 71.22 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 73.25 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD23 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.21 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 71.13 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.676 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 52.22 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.444 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 72.55 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 65.4 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.456 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 54.4 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 15.41 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 73.23 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.506 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 72.23 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 64.31 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 42.12 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 72.11 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.659 ' HD2' HD21 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 71.32 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.461 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.601 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 65.34 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 64.34 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . 0.601 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 51.55 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 54.41 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.659 HD21 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 74.52 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 72.04 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 60.3 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.57 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 73.43 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.523 HG22 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 65.32 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 53.42 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 62.14 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 42.42 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.715 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 70.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 72.22 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 71.32 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.715 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 62.33 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.545 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 72.41 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm . . . . . 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 71.24 112.892 171.402 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 . . . . . 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 64.43 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 63.21 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 74.31 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 72.25 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 72.43 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 61.45 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.47 HG21 ' NZ ' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 51.5 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 63.34 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.759 HG11 HD21 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 73.13 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.556 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 73.41 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.737 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HG3' HG23 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.606 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.602 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 51.3 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 71.14 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 74.13 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 64.22 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HB2' HD11 ' A' ' 118' ' ' LEU . 14.6 mm100 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 72.24 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 73.31 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.12 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 72.34 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 54.23 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HB2' HG21 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 74.43 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 70.5 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 53.0 111.281 172.494 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.3 pt . . . . . 0 CA--C 1.554 1.132 0 CA-C-O 121.286 0.565 . . . . 71.23 111.625 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 65.41 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.562 ' HG3' HG13 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 55.22 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.658 HG22 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 52.03 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 34.04 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 74.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.459 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 74.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.43 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 71.25 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 34.32 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.533 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 63.03 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 52.11 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.509 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.524 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.11 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.23 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 71.13 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.49 ' HG3' HD22 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.759 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.427 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 71.32 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.47 ' NZ ' HG21 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.32 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.02 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 42.33 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.595 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 62.32 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 74.43 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' A' ' 107' ' ' ILE . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.509 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 63.44 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.476 HG21 HD13 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 63.32 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 103' ' ' PHE . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 33.21 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 62.22 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.476 HD13 HG21 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.11 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 61.44 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.469 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 72.11 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.407 ' HB2' ' HE3' ' A' ' 124' ' ' MET . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 64.33 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 73.23 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 44.41 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 62.11 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.701 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.41 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 54.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 42.54 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 63.34 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 45.45 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.58 ' HE2' HD23 ' B' ' 137' ' ' LEU . 91.6 mttt . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 73.23 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.402 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 65.25 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 61.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 50.45 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . 0.463 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 51.11 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 71.51 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 60.45 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.453 HD11 HD21 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.619 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 74.42 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 71.5 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 61.54 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HB2' HD11 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 60.21 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.535 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 61.23 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.619 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 71.24 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 70.21 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 51.55 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.446 ' O ' HG22 ' B' ' 48' ' ' VAL . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 54.02 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.468 HG23 HD22 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.468 HD22 HG23 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 70.42 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t . . . . . 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 73.21 110.957 178.801 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.404 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 2.9 pp . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 120.95 0.405 . . . . 64.42 111.651 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.406 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 63.2 115.34 -172.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.471 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 72.25 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.404 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 50.24 110.721 173.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.518 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 64.31 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.453 HD21 HD11 ' B' ' 30' ' ' ILE . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 71.32 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 54.2 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.552 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 64.02 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 60.31 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.552 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 31.24 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.465 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 60.23 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 73.04 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 54.22 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 73.2 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 61.32 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 62.3 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 71.22 111.046 176.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 73.25 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.21 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 71.13 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.446 ' O ' HG13 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 52.22 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 72.55 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 65.4 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.516 HG23 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 54.4 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.516 HG23 HG23 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 15.41 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 73.23 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 72.23 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 64.31 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 42.12 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.469 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 72.11 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.423 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 71.32 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . 0.465 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.56 HG21 HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 65.34 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 64.34 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 51.55 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 54.41 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.56 HD13 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 74.52 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 72.04 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 60.3 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.416 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 73.43 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 65.32 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 53.42 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 62.14 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.457 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 42.42 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.455 HG13 HD11 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 70.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.457 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 72.22 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 71.32 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.548 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 62.33 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 72.41 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.467 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt . . . . . 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 71.24 111.079 171.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 . . . . . 0 CA--C 1.554 1.104 0 N-CA-C 111.99 0.367 . . . . 74.54 111.99 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 64.43 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.427 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 63.21 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 74.31 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 72.25 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 72.43 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.4 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.448 ' HG3' HD12 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 61.45 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 51.5 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 17' ' ' PHE . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 63.34 111.319 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.523 HG22 ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.739 HG11 HD21 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 73.13 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 HD11 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 73.41 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.557 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' HD11 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 51.3 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 71.14 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 74.13 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 64.22 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 72.24 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 73.31 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.12 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 72.34 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 54.23 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 74.43 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 70.5 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.579 HG22 HG23 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 28' ' ' SER . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 53.0 112.92 179.158 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 40.6 pt . . . . . 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 71.23 113.614 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 65.41 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HE3' ' HD2' ' A' ' 27' ' ' PRO . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 55.22 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.557 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 52.03 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 34.04 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.579 HG23 HG22 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 74.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 74.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.43 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 71.25 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 34.32 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 63.03 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 52.11 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.11 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.23 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.405 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 71.13 111.533 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.456 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' HD22 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.739 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 71.32 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.32 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.02 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 42.33 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 62.32 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 102' ' ' VAL . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 74.43 121.139 -164.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 63.44 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.511 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 63.32 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 106' ' ' ILE . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 33.21 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 62.22 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.11 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 61.44 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.513 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 72.11 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 64.33 109.694 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 73.23 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 44.41 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 62.11 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.587 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.8 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.41 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 54.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.587 HG22 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 42.54 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.586 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 63.34 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 45.45 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.553 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.5 mtpm? . . . . . 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 . . . . . 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 73.23 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 65.25 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 61.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.536 HG21 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 50.45 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.512 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.656 HG11 HD21 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 51.11 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 71.51 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.729 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 60.45 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.439 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 74.42 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 71.5 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 61.54 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 60.21 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 61.23 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 71.24 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . 0.427 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 8.7 m-80 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 70.21 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 51.55 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 54.02 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.439 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 70.42 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p . . . . . 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 73.21 112.448 179.588 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.427 HG22 HH11 ' B' ' 59' ' ' ARG . 2.8 pp . . . . . 0 CA--C 1.559 1.315 0 N-CA-C 111.927 0.343 . . . . 64.42 111.927 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 63.2 112.83 -172.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.504 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 72.25 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.427 HH11 HG22 ' B' ' 56' ' ' ILE . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 50.24 111.528 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.729 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.5 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 64.31 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 71.32 111.956 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 54.2 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 64.02 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 60.31 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 31.24 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . 0.462 ' O ' HG23 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 60.23 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 73.04 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.462 HG23 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 54.22 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 73.2 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 61.32 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 62.3 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 71.22 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 73.25 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.21 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.403 ' HG3' HD22 ' B' ' 90' ' ' LEU . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 71.13 111.299 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.656 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 52.22 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 72.55 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.536 ' NZ ' HG21 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 65.4 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.461 HG22 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 54.4 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.438 HG23 HG23 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 15.41 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 73.23 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 72.23 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.524 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 64.31 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 42.12 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 72.11 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.428 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 71.32 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.42 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 65.34 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 64.34 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 51.55 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 54.41 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 106' ' ' ILE . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 74.52 111.874 178.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 72.04 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 60.3 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.495 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 73.43 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 65.32 110.475 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.495 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 53.42 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 62.14 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.535 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 42.42 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.729 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.4 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 70.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 72.22 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 71.32 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.729 HG22 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 62.33 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 72.41 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.553 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 9.6 mtpm? . . . . . 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 71.24 110.896 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.462 ' HB3' ' NE2' ' A' ' 69' ' ' GLN . 4.8 p-10 . . . . . 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 64.43 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 63.21 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 74.31 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 72.25 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 72.43 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.594 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 61.45 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 51.5 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.454 HD11 HG11 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 63.34 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.703 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 73.13 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 73.41 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.643 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.48 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.672 HG22 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 51.3 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 71.14 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 74.13 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.403 ' HG2' HD22 ' A' ' 40' ' ' LEU . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 64.22 111.216 170.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 72.24 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.418 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 73.31 112.85 172.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.672 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.12 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 72.34 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 54.23 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 74.43 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.615 ' HB3' HD21 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 70.5 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 9.9 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 53.0 109.531 170.94 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt . . . . . 0 N--CA 1.483 1.184 0 N-CA-C 112.27 0.471 . . . . 71.23 112.27 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 65.41 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 55.22 112.634 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 52.03 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 34.04 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.643 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 74.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 74.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.43 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.462 ' NE2' ' HB3' ' A' ' 8' ' ' ASP . 53.2 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 71.25 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 34.32 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG23 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.529 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 63.03 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 52.11 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.11 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.23 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 71.13 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD22 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.703 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.624 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 71.32 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 20' ' ' THR . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.32 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.594 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.02 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.446 HG23 HG23 ' A' ' 94' ' ' VAL . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 42.33 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.584 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.584 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 62.32 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.515 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 74.43 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.467 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 63.44 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 63.32 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 33.21 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HA ' HD12 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 62.22 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.11 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 61.44 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.504 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 72.11 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.429 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 64.33 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 73.23 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 44.41 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 62.11 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.41 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 54.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.562 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 42.54 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 63.34 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 45.45 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 . . . . . 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 73.23 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.432 HD21 HD21 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 65.25 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 61.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.465 HG21 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 50.45 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.694 HD23 HD12 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.485 HG11 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 51.11 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 71.51 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.652 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 60.45 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.47 HG12 ' HA ' ' B' ' 27' ' ' PRO . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 74.42 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 71.5 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 61.54 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.665 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 60.21 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.625 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 61.23 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 71.24 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 70.21 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 51.55 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 54.02 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.6 HG22 HG23 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.528 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 70.42 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t . . . . . 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 73.21 108.913 163.513 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 64.42 112.715 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 63.2 113.312 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.582 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 72.25 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 50.24 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.652 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 64.31 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.6 HG23 HG22 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 71.32 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 54.2 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 64.02 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 60.31 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 31.24 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.497 ' HB3' HG12 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 60.23 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.445 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 73.04 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 54.22 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 73.2 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.538 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 61.32 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 62.3 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.529 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 71.22 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 73.25 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.21 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 71.13 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.694 HD12 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 52.22 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.463 ' HA ' HG22 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 72.55 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.465 ' HE3' HG21 ' B' ' 20' ' ' THR . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 65.4 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 54.4 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.425 HG23 HG23 ' B' ' 94' ' ' VAL . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 15.41 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 73.23 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 72.23 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.453 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 64.31 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 42.12 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 72.11 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.529 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 71.32 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.517 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 65.34 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 64.34 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.625 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 51.55 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 54.41 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.517 HD13 HG21 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 74.52 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 72.04 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 60.3 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.484 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 73.43 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.468 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 65.32 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 53.42 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 62.14 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' B' ' 124' ' ' MET . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 42.42 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.491 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 70.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 72.22 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 71.32 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.491 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 62.33 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 72.41 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 71.24 112.615 -179.45 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.453 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 . . . . . 0 CA--C 1.555 1.165 0 N-CA-C 111.766 0.284 . . . . 74.54 111.766 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 64.43 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 63.21 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 74.31 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 72.25 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 72.43 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.429 ' HA ' HD12 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 61.45 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 51.5 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 63.34 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG11 HD21 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 73.13 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 HD11 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 73.41 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.659 ' HB3' HD22 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.536 HG23 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 51.3 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.444 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 71.14 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 74.13 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 64.22 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 12.8 mm100 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 72.24 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 73.31 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.12 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 72.34 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 54.23 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 74.43 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 70.5 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t . . . . . 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 53.0 111.406 174.247 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 71.23 112.497 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.64 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 65.41 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 63' ' ' VAL . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 55.22 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 52.03 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 34.04 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.589 HG12 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.659 HD22 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 74.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 74.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.43 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 71.25 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 34.32 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 63.03 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 52.11 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.11 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.589 HD11 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.23 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.62 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 71.13 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' A' ' 90' ' ' LEU . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.441 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 71.32 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.595 ' HD3' HD13 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.32 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.593 HG23 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.02 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.593 HG23 HG23 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 42.33 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.449 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 62.32 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 74.43 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.517 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 63.44 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 63.32 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.666 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 33.21 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.666 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 62.22 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.11 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 61.44 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.48 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 72.11 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 64.33 109.955 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 73.23 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 44.41 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 62.11 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.522 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.41 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 54.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.522 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 42.54 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 63.34 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 45.45 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm . . . . . 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 N--CA 1.486 1.332 0 N-CA-C 113.293 0.849 . . . . 63.54 113.293 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 73.23 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 65.25 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 61.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 50.45 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.524 HG22 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.589 HG11 HD21 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 51.11 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 71.51 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.478 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 60.45 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.522 ' HG3' HG23 ' B' ' 30' ' ' ILE . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 74.42 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.494 HD13 HD21 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 71.5 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 61.54 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.453 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.7 mm100 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 60.21 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.61 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 61.23 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.655 HD12 HD11 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 71.24 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 70.21 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 51.55 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 54.02 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.556 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 70.42 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 73.21 112.452 170.212 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp . . . . . 0 N--CA 1.483 1.203 0 N-CA-C 112.134 0.42 . . . . 64.42 112.134 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.404 ' O ' HG23 ' B' ' 61' ' ' VAL . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 63.2 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.469 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 72.25 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 50.24 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.478 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.524 ' HB ' HG22 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 64.31 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.655 HD11 HD12 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 71.32 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 54.2 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 64.02 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.494 HD21 HD13 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 60.31 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 31.24 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . 0.577 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 60.23 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 73.04 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 54.22 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 73.2 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 61.32 110.737 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 62.3 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 71.22 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . 0.505 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 73.25 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.21 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 71.13 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.589 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 52.22 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.583 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 72.55 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.587 ' HD3' HD13 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 65.4 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.403 HG23 HG23 ' B' ' 95' ' ' THR . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 54.4 112.309 174.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.403 HG23 HG23 ' B' ' 94' ' ' VAL . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 15.41 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 73.23 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 72.23 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 64.31 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 42.12 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . 0.436 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 72.11 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.447 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 71.32 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . 0.461 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.447 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 65.34 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 64.34 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.61 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 51.55 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 54.41 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 74.52 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 72.04 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.453 HD11 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 60.3 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 73.43 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.425 ' HB2' ' HE2' ' B' ' 124' ' ' MET . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 65.32 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 53.42 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 62.14 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 42.42 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 126' ' ' LEU . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.485 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 70.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 72.22 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 71.32 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.485 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 62.33 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.538 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 72.41 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm . . . . . 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 71.24 110.647 -176.745 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.492 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 . . . . . 0 N--CA 1.48 1.027 0 CA-C-O 120.594 0.235 . . . . 74.54 111.412 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 64.43 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 63.21 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 74.31 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 72.25 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 72.43 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' HG12 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 61.45 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.474 HG21 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 51.5 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 63.34 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.725 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.513 HG11 HD21 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 73.13 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 73.41 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.483 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 51.3 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 71.14 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 74.13 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 64.22 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 72.24 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 73.31 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD11 HG22 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.12 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 72.34 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 54.23 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.605 ' HA ' HE21 ' A' ' 47' ' ' GLN . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 74.43 112.043 -174.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 70.5 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.686 HE22 HD11 ' A' ' 67' ' ' ILE . 4.6 pp0? -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 53.0 109.856 179.047 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt . . . . . 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 71.23 113.224 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.725 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 65.41 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 55.22 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.486 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 52.03 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 34.04 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 74.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.686 HD11 HE22 ' A' ' 47' ' ' GLN . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 74.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.43 111.411 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . 0.492 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 71.25 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.466 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 34.32 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HE2' ' HB ' ' A' ' 71' ' ' THR . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 63.03 110.751 169.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.61 ' HA ' HD12 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 52.11 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.403 ' OE2' ' HA ' ' A' ' 103' ' ' PHE . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.11 110.851 171.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.23 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 99' ' ' PRO . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HB2' ' HZ ' ' A' ' 103' ' ' PHE . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 71.13 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.614 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 71.32 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.32 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.639 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.02 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.639 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 42.33 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.614 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HA ' ' HG3' ' A' ' 84' ' ' GLU . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 62.32 112.301 167.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 74.43 111.919 -169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 63.44 110.988 176.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 63.32 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.459 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.634 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 33.21 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 62.22 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.11 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 61.44 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 72.11 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.452 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 64.33 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 73.23 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 44.41 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 62.11 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.41 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 54.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 42.54 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.641 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 63.34 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 45.45 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt . . . . . 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 73.23 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.605 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 65.25 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.504 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.605 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 61.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 50.45 110.364 174.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.693 HG22 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.487 HG11 HD21 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 51.11 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.574 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 71.51 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.597 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 60.45 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.517 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 74.42 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . 0.492 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 71.5 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 61.54 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.568 ' HG3' HD21 ' B' ' 118' ' ' LEU . 16.8 mm100 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 60.21 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.565 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 61.23 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.517 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 71.24 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 70.21 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 51.55 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.701 ' HA ' HE21 ' B' ' 47' ' ' GLN . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 54.02 111.768 -173.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.477 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.701 HE21 ' HA ' ' B' ' 44' ' ' ASP . 4.5 pp0? -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . 0.456 HG22 HG23 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 70.42 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 73.21 112.761 178.345 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt . . . . . 0 N--CA 1.487 1.416 0 N-CA-C 111.94 0.348 . . . . 64.42 111.94 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.415 ' O ' HG23 ' B' ' 61' ' ' VAL . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 72.25 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 50.24 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.693 ' HB ' HG22 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 64.31 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.456 HG23 HG22 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . 0.42 HD22 ' HG3' ' B' ' 27' ' ' PRO . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 71.32 111.048 172.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 54.2 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.414 HD11 HE22 ' B' ' 47' ' ' GLN . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 64.02 111.58 176.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 60.31 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 31.24 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . 0.479 ' O ' HG23 ' B' ' 77' ' ' VAL . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 60.23 111.559 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.449 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 73.04 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 54.22 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 73.2 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.512 ' HB2' HG11 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 61.32 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.508 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 62.3 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.548 ' HA ' ' HE1' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 71.22 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 73.25 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.21 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 71.13 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.487 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 52.22 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.47 ' HA ' HG22 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . 0.575 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 72.55 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 65.4 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.615 HG23 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 54.4 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.615 HG23 HG23 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 15.41 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 73.23 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 72.23 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 64.31 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . 0.406 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 42.12 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 72.11 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.512 HG11 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.42 ' O ' HG12 ' B' ' 107' ' ' ILE . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 71.32 114.626 -169.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 103' ' ' PHE . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 65.34 110.789 172.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 64.34 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.565 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 51.55 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 54.41 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 74.52 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 72.04 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.568 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 60.3 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.478 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 73.43 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.525 HG21 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 65.32 110.389 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 53.42 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 62.14 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 42.42 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.504 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 70.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 72.22 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.528 HD13 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 71.32 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.504 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 62.33 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.61 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 72.41 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 71.24 110.379 178.089 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.556 1.211 0 CA-C-O 120.722 0.296 . . . . 74.54 111.226 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 64.43 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.661 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 63.21 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 74.31 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 72.25 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.661 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 72.43 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 61.45 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 51.5 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.454 HD23 HD12 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 63.34 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 73.13 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.405 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 73.41 110.917 -173.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.592 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 51.3 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 71.14 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 74.13 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 64.22 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 118' ' ' LEU . 17.0 mm100 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 72.24 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.622 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 73.31 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.12 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 72.34 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 54.23 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.504 ' HB3' HD13 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 74.43 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 70.5 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t . . . . . 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 53.0 112.094 177.025 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.42 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt . . . . . 0 N--CA 1.488 1.435 0 N-CA-C 112.019 0.377 . . . . 71.23 112.019 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 65.41 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 55.22 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.592 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 34.04 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 74.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.504 HD13 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 74.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.43 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.47 ' NH2' HG23 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 71.25 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 34.32 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 63.03 111.009 170.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 52.11 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB2' HG11 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.11 111.621 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 83' ' ' LEU . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.23 110.494 -177.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.47 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.438 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 71.13 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.591 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 71.32 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.531 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.32 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.02 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.689 HG23 HG23 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 42.33 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 62.32 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . 0.542 HG11 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 74.43 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . 0.44 ' HB2' ' HE2' ' A' ' 105' ' ' MET . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 63.44 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.401 ' O ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 63.32 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 33.21 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 62.22 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.11 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.525 HD21 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 61.44 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 72.11 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 119' ' ' LEU . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 64.33 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.439 ' O ' HG23 ' A' ' 130' ' ' VAL . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 73.23 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 44.41 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.527 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 62.11 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.74 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.41 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 54.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 42.54 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 63.34 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 45.45 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.461 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm . . . . . 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 73.23 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 65.25 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . 0.4 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 61.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . 0.4 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 50.45 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.467 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.685 HG11 HD21 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 51.11 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 71.51 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 60.45 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.518 HG22 HD11 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 74.42 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.464 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.496 HD13 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 71.5 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 61.54 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.614 ' HG3' HD21 ' B' ' 118' ' ' LEU . 15.2 mm100 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 60.21 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.508 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 61.23 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.518 HD11 HG22 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 71.24 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' HD23 ' B' ' 40' ' ' LEU . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 70.21 110.157 176.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 51.55 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.404 ' HA ' HE21 ' B' ' 47' ' ' GLN . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 54.02 112.079 -177.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' B' ' 44' ' ' ASP . 30.4 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 70.42 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 73.21 110.738 166.152 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . 0.429 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp . . . . . 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 64.42 113.954 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 63.2 111.689 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 72.25 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 50.24 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.467 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 64.31 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' B' ' 60' ' ' LYS . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 71.32 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 54.2 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . 0.573 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . 0.558 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 64.02 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.496 HD21 HD13 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 60.31 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 31.24 114.75 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 60.23 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 73.04 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 54.22 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 73.2 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.532 ' HB2' HG11 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 61.32 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 62.3 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.406 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 71.22 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 73.25 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . 0.542 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.21 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . 0.425 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 71.13 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.685 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 52.22 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 72.55 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.544 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 65.4 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . 0.467 HG23 HG23 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 54.4 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . 0.467 HG23 HG23 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 15.41 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 73.23 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 72.23 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 64.31 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 42.12 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 72.11 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.516 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 71.32 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.435 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.516 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 65.34 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 64.34 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 51.55 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 54.41 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 74.52 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 72.04 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . 0.614 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 60.3 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . 0.447 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 73.43 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.47 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 65.32 110.445 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.459 ' O ' HG23 ' B' ' 130' ' ' VAL . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 53.42 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 62.14 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 42.42 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 70.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 72.22 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 71.32 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 62.33 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 72.41 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.461 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm . . . . . 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 71.24 112.815 -171.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 . . . . . 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 64.43 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 63.21 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 74.31 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 72.25 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 72.43 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.471 ' HG2' HD12 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 61.45 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 51.5 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.616 HD23 HD12 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 63.34 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.456 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.455 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 73.13 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 73.41 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.782 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 27' ' ' PRO . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 51.3 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 71.14 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 74.13 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 64.22 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 72.24 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 73.31 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.799 HD21 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.12 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 72.34 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 54.23 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.66 ' HB3' HD13 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 74.43 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.799 ' HB3' HD21 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 70.5 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.438 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 53.0 110.734 169.931 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt . . . . . 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 71.23 114.082 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.654 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.456 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 65.41 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.654 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 55.22 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' VAL . . . . . 0.782 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 52.03 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 34.04 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 74.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 74.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.43 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 71.25 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 34.32 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 63.03 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.414 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 52.11 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.11 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.23 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TYR . . . . . 0.532 ' HB3' HD23 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 71.13 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' PRO . . . . . 0.763 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD22 ' A' ' 90' ' ' LEU . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 95' ' ' THR . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LYS . . . . . 0.409 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 71.32 112.224 177.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.436 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.32 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.02 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 42.33 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.467 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 62.32 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.763 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 74.43 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . 0.438 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 63.44 111.412 170.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 63.32 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.481 HG23 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 33.21 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.481 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 62.22 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' LEU . . . . . 0.457 ' HB2' HD12 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.11 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 61.44 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.406 ' O ' HG22 ' A' ' 123' ' ' VAL . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 72.11 112.895 176.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' VAL . . . . . 0.496 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' MET . . . . . 0.426 ' HE2' ' HB2' ' A' ' 124' ' ' MET . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 64.33 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 73.23 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 44.41 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 62.11 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLN . . . . . 0.545 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.41 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 54.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 42.54 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.547 ' HB2' HD11 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 63.34 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' LEU . . . . . 0.507 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 45.45 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' LYS . . . . . 0.445 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.2 mtpm? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 73.23 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 65.25 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.42 ' O ' HG23 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 61.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 50.45 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' LEU . . . . . 0.731 HD23 HD12 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . 0.566 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' VAL . . . . . 0.506 HG11 HD21 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 51.11 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' ASP . . . . . 0.454 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 71.51 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.853 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 60.45 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ILE . . . . . 0.691 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' THR . . . . . 0.411 ' HA ' HD13 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 74.42 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.543 HD13 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 71.5 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 61.54 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 60.21 111.226 170.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 61.23 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 71.24 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 70.21 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 51.55 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 54.02 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.563 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 70.42 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 73.21 110.308 167.206 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.494 1.739 0 N-CA-C 111.979 0.363 . . . . 64.42 111.979 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' ARG . . . . . 0.454 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 63.2 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' LYS . . . . . 0.519 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 72.25 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 50.24 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.428 ' HD2' ' HD2' ' B' ' 27' ' ' PRO . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' VAL . . . . . 0.853 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 64.31 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 71.32 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' LEU . . . . . 0.408 HD12 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 54.2 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 64.02 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' LEU . . . . . 0.543 HD11 HD13 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 60.31 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' ARG . . . . . 0.566 ' HG3' HG23 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.566 HG23 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 31.24 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 60.23 111.297 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 73.04 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 54.22 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 73.2 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 61.32 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 62.3 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.624 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 71.22 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 73.25 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.21 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 71.13 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 90' ' ' LEU . . . . . 0.731 HD12 HD23 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 52.22 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 91' ' ' TYR . . . . . 0.403 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 72.55 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 93' ' ' LYS . . . . . 0.453 ' HD2' HD13 ' B' ' 90' ' ' LEU . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 65.4 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 54.4 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 15.41 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 73.23 111.997 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 72.23 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 99' ' ' PRO . . . . . 0.403 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 64.31 112.654 172.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 42.12 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 72.11 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 71.32 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 106' ' ' ILE . . . . . 0.516 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 65.34 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 64.34 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 51.55 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 54.41 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 115' ' ' LEU . . . . . 0.516 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 74.52 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 72.04 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 60.3 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.624 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 73.43 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 123' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 124' ' ' MET . . . . . 0.437 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 65.32 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 126' ' ' LEU . . . . . 0.418 ' O ' HG23 ' B' ' 130' ' ' VAL . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 53.42 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 127' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 62.14 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 128' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 129' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 42.42 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 130' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 126' ' ' LEU . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 131' ' ' GLN . . . . . 0.592 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 70.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 72.22 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 133' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 71.32 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 134' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 62.33 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 136' ' ' LEU . . . . . 0.507 ' HB2' HD11 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 137' ' ' LEU . . . . . 0.547 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 72.41 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 140' ' ' LYS . . . . . 0.445 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt . . . . . 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 71.24 113.775 -175.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 2.676 0 CA-C-O 119.789 -0.451 . . . . 74.14 113.022 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.6 t 60.25 -170.04 0.15 Allowed 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.157 0.983 . . . . 73.52 110.922 -173.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -157.16 -166.31 2.03 Favored 'General case' 0 N--CA 1.483 1.187 0 O-C-N 121.765 -0.584 . . . . 72.41 110.202 177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -133.65 -22.97 1.86 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.179 0.592 . . . . 63.31 111.771 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -81.7 147.66 29.38 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 112.907 0.706 . . . . 54.42 112.907 -173.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -96.51 104.84 16.85 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.962 0.905 . . . . 72.04 110.456 -177.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -168.2 173.75 7.64 Favored 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 123.021 0.528 . . . . 73.33 110.428 177.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -67.6 -28.78 68.05 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.053 0.541 . . . . 74.54 111.082 169.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -54.35 -31.19 53.97 Favored 'General case' 0 N--CA 1.496 1.846 0 C-N-CA 124.828 1.251 . . . . 64.43 112.17 174.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.591 ' SG ' ' HA ' ' A' ' 73' ' ' HIS . 42.9 t -51.34 -43.93 61.89 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 125.105 1.362 . . . . 71.05 112.287 173.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -65.32 -17.95 64.92 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 116.604 2.076 . . . . 75.1 116.604 -179.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.8 m -49.83 -29.85 8.72 Favored 'General case' 0 N--CA 1.51 2.532 0 N-CA-C 114.203 1.186 . . . . 63.21 114.203 -169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.5 t -61.57 -54.61 32.52 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.945 0.898 . . . . 74.31 111.802 172.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 82.3 mt -68.25 -31.9 71.71 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.486 0.715 . . . . 72.25 112.292 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -54.42 -44.97 72.88 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.75 0.82 . . . . 72.43 112.995 -178.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.18 -20.55 36.0 Favored Glycine 0 CA--C 1.54 1.639 0 N-CA-C 115.175 0.83 . . . . 74.12 115.175 175.656 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -116.12 5.84 13.87 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.33 0.652 . . . . 71.22 111.624 179.369 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -50.21 -47.66 54.71 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.474 1.11 . . . . 61.45 113.317 -176.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -58.52 -35.76 56.15 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 C-N-CA 123.333 0.653 . . . . 64.01 112.071 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 29.3 m -77.05 -44.17 31.72 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.667 0.787 . . . . 51.5 110.658 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 97.6 mt -61.55 -35.48 77.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.518 0.727 . . . . 63.34 112.08 -177.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.643 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 37.5 p -74.45 -34.29 63.15 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 112.881 0.697 . . . . 74.21 112.881 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.4 p -83.71 -30.85 26.41 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.247 0.619 . . . . 71.13 112.502 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.556 HG11 HD21 ' A' ' 90' ' ' LEU . 74.1 t -86.07 -46.96 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.736 0.814 . . . . 73.13 113.153 -177.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -80.14 146.86 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 CA-C-O 121.309 0.576 . . . . 73.41 112.527 -173.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 16.0 m-20 -116.82 114.72 39.41 Favored Pre-proline 0 C--O 1.261 1.66 0 C-N-CA 124.046 0.938 . . . . 72.35 109.867 172.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 50.2 Cg_exo -54.3 -18.21 13.79 Favored 'Trans proline' 0 C--N 1.388 2.646 0 C-N-CA 123.037 2.491 . . . . 65.41 112.922 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.9 m -63.88 -28.97 70.2 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.576 0.75 . . . . 62.52 111.237 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 ptp85 -95.89 -29.85 13.97 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 113.19 0.811 . . . . 75.22 113.19 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.442 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.6 pt -94.43 -19.6 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 N-CA-C 113.243 0.831 . . . . 72.12 113.243 -174.028 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.478 HG22 HD11 ' A' ' 40' ' ' LEU . 23.8 p -59.7 -45.74 98.52 Favored Pre-proline 0 N--CA 1.5 2.042 0 CA-C-O 117.901 -1.047 . . . . 51.3 113.519 -179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -66.33 -28.55 46.97 Favored 'Trans proline' 0 C--N 1.399 3.228 0 CA-C-N 121.759 1.664 . . . . 64.4 112.679 178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -66.74 -49.43 66.02 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.646 0.778 . . . . 71.14 110.774 172.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 94.1 mt -64.36 -20.73 66.3 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.676 0.791 . . . . 74.13 112.828 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 31' ' ' THR . 22.7 mmm180 -61.13 -52.31 65.39 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.12 0.568 . . . . 64.22 110.198 169.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.38 -23.65 62.81 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.61 0.764 . . . . 72.24 112.346 178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.3 m -72.4 -13.25 61.41 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.088 0.555 . . . . 74.01 111.298 169.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 33.7 mmtp 66.66 21.38 10.63 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 125.296 1.438 . . . . 73.31 112.7 172.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -101.9 -35.9 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.923 0.889 . . . . 63.51 111.266 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.478 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -94.91 127.24 40.8 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.89 0.876 . . . . 75.12 110.255 -179.074 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -96.09 160.42 29.98 Favored Pre-proline 0 CA--C 1.559 1.31 0 C-N-CA 124.531 1.132 . . . . 72.34 110.5 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -61.17 -14.91 36.46 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 122.838 2.358 . . . . 54.23 114.562 -173.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -77.4 -38.59 49.52 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.122 0.969 . . . . 73.22 111.683 177.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.678 ' HB3' HD13 ' A' ' 67' ' ' ILE . 55.8 m-20 -68.71 -49.64 57.3 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.54 1.136 . . . . 74.43 112.469 -174.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -55.77 -34.59 65.38 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.833 -0.621 . . . . 71.35 111.367 173.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -68.38 -47.02 68.47 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.09 0.556 . . . . 70.5 111.973 174.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -67.43 -36.72 81.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 111.861 0.319 . . . . 74.1 111.861 -174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 31.0 m -75.13 -39.07 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 O-C-N 122.451 -0.156 . . . . 74.12 111.275 176.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -83.16 11.48 6.41 Favored 'General case' 0 N--CA 1.496 1.828 0 N-CA-C 112.675 0.62 . . . . 71.54 112.675 176.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.37 -33.83 73.01 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.302 0.573 . . . . 53.0 110.744 173.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.474 ' HB3' ' HE3' ' A' ' 60' ' ' LYS . 37.4 t70 -96.65 107.13 34.62 Favored Pre-proline 0 CA--C 1.559 1.308 0 N-CA-C 108.402 -0.962 . . . . 73.24 108.402 164.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -65.45 -34.16 44.24 Favored 'Trans proline' 0 CA--C 1.559 1.771 0 C-N-CA 122.189 1.926 . . . . 74.43 113.574 -179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.527 ' HB2' HG23 ' A' ' 55' ' ' VAL . 66.1 m-20 -84.08 -172.32 4.09 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.603 0.716 . . . . 71.45 112.39 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.7 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.4 pt? -91.64 17.97 8.12 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.347 1.059 . . . . 73.21 112.881 176.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.527 HG23 ' HB2' ' A' ' 53' ' ' ASN . 50.9 t -57.88 -49.2 81.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 C-N-CA 123.327 0.651 . . . . 63.23 112.109 -172.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.475 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 39.7 pt -118.84 28.16 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 123.729 0.812 . . . . 71.23 111.676 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -25.07 26.91 Favored 'General case' 0 N--CA 1.505 2.302 0 N-CA-C 113.07 0.767 . . . . 71.4 113.07 -175.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.412 ' O ' ' HB ' ' A' ' 22' ' ' THR . 24.0 tptm -55.4 -56.39 20.66 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.495 1.118 . . . . 65.41 111.358 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.475 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 18.5 ptp180 -77.08 -18.46 58.0 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 112.631 0.604 . . . . 74.31 112.631 179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.595 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 57.0 mttp -58.74 -54.75 43.6 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 118.435 0.561 . . . . 55.22 111.27 174.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.643 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 15.3 t -68.53 -32.56 55.78 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 CA-C-N 116.299 -0.41 . . . . 52.03 110.08 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.5 -48.17 82.94 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.225 0.328 . . . . 34.04 113.439 176.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 25.9 m -72.66 -31.7 38.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.97 0 C-N-CA 122.461 0.305 . . . . 73.12 111.165 175.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.712 ' HA ' HD12 ' A' ' 67' ' ' ILE . 42.9 tp -63.28 -38.22 90.29 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.264 0.626 . . . . 75.04 112.419 176.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.4 mt -59.7 -42.72 93.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.685 0.394 . . . . 74.53 110.21 174.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -64.79 -39.63 93.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.02 0.928 . . . . 72.51 111.699 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.712 HD12 ' HA ' ' A' ' 64' ' ' LEU . 96.9 mt -56.07 -52.9 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 124.364 1.065 . . . . 74.32 110.921 172.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.423 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 83.6 mt -74.1 -21.35 59.93 Favored 'General case' 0 CA--C 1.568 1.669 0 CA-C-N 114.75 -1.114 . . . . 74.43 112.051 -176.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 -70.17 -26.77 64.06 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 123.292 0.637 . . . . 74.21 112.116 172.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.9 mtt180 -61.02 -32.37 71.97 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.164 0.507 . . . . 71.25 111.019 174.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.404 ' HB ' ' HB2' ' A' ' 74' ' ' LYS . 44.6 p -96.74 5.96 49.63 Favored 'General case' 0 CA--C 1.559 1.304 0 CA-C-N 115.516 -0.765 . . . . 34.32 111.39 178.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 52.67 -107.43 0.53 Allowed Glycine 0 C--N 1.355 1.626 0 N-CA-C 115.885 1.114 . . . . 74.52 115.885 178.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.591 ' HA ' ' SG ' ' A' ' 10' ' ' CYS . 81.4 t60 -70.98 -33.61 70.6 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.948 0.899 . . . . 75.22 111.686 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.404 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 mmmt -53.41 -57.96 8.81 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.419 0.688 . . . . 73.31 111.287 175.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 68' ' ' LEU . . . -66.03 -37.47 93.18 Favored Glycine 0 CA--C 1.534 1.219 0 CA-C-N 115.415 -0.811 . . . . 61.24 114.1 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.431 ' CD1' ' SG ' ' A' ' 10' ' ' CYS . 79.2 t80 -54.0 -59.01 5.21 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.574 0.75 . . . . 63.03 112.152 172.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 95.8 t -59.82 -42.34 88.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.361 0.664 . . . . 52.11 111.449 178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.14 -40.1 94.81 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 112.265 0.469 . . . . 75.13 112.265 178.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -68.28 -42.82 78.95 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 122.25 -0.281 . . . . 72.43 110.404 176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.457 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.3 mt -55.25 -47.38 75.49 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.238 0.615 . . . . 61.01 111.631 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.407 ' OE1' ' HB3' ' A' ' 105' ' ' MET . 38.1 tt0 -68.22 -43.38 78.11 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.187 1.395 . . . . 72.11 111.845 -174.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 82.7 p -68.94 -35.32 76.65 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 116.064 -0.516 . . . . 71.42 110.616 173.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -70.18 -32.3 70.18 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-O 121.242 0.544 . . . . 75.23 110.611 176.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -70.11 -38.16 75.53 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.243 1.017 . . . . 74.2 110.92 -178.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.503 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.6 tt -76.2 -57.81 3.65 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 123.488 0.715 . . . . 73.32 110.47 176.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 96.1 m-85 -80.54 -45.57 17.2 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.711 1.004 . . . . 74.13 113.711 -170.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -120.39 76.78 25.8 Favored Pre-proline 0 N--CA 1.497 1.916 0 CA-C-N 118.671 0.669 . . . . 71.13 112.04 -176.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -61.9 -36.3 73.15 Favored 'Trans proline' 0 C--N 1.372 1.815 0 C-N-CA 122.813 2.342 . . . . 73.31 114.257 -170.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.56 ' HG3' HD22 ' A' ' 90' ' ' LEU . 20.7 pt20 -74.18 -31.8 62.82 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.462 0.305 . . . . 71.11 111.621 178.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.56 HD22 ' HG3' ' A' ' 89' ' ' GLN . 4.1 mm? -68.42 -39.17 81.68 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.95 0.5 . . . . 71.42 110.571 175.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.457 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 65.3 t80 -65.76 -46.63 78.08 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 120.984 0.421 . . . . 73.1 110.277 174.267 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -49.87 -46.74 51.88 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.22 1.008 . . . . 71.32 112.469 174.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.522 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -73.2 -44.37 59.83 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 112.591 0.589 . . . . 75.32 112.591 179.716 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' A' ' 91' ' ' TYR . 21.7 m -65.0 -32.91 60.36 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.762 0 N-CA-C 113.217 0.821 . . . . 74.02 113.217 -177.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 60.3 p -92.26 -33.39 14.67 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 122.599 0.36 . . . . 62.14 111.86 179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 -4.65 74.88 Favored Glycine 0 CA--C 1.538 1.515 0 CA-C-N 116.379 -0.373 . . . . 42.33 113.345 -178.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.24 -179.54 6.05 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 71.11 110.923 178.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -59.26 156.18 30.77 Favored Pre-proline 0 CA--C 1.565 1.542 0 C-N-CA 124.348 1.059 . . . . 74.21 112.686 178.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.455 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 81.9 Cg_exo -47.98 113.75 0.89 Allowed 'Trans proline' 0 C--N 1.384 2.412 0 C-N-CA 123.288 2.659 . . . . 62.32 114.07 172.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.51 -34.27 77.87 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.689 0.796 . . . . 62.45 111.883 -178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 81.94 41.71 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 126.476 1.91 . . . . 71.13 110.339 172.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -81.51 47.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.505 0 C-N-CA 124.447 1.099 . . . . 74.43 111.872 179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.499 ' O ' HG12 ' A' ' 107' ' ' ILE . 95.3 m-85 -65.02 -3.37 3.49 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 123.754 0.821 . . . . 74.41 112.834 172.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.5 m -56.78 -21.03 25.54 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 125.103 1.361 . . . . 62.55 112.826 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.407 ' HB3' ' OE1' ' A' ' 81' ' ' GLU . 10.4 tpt -64.73 -61.43 2.19 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.486 1.115 . . . . 63.44 111.338 175.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -25.81 30.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 C-N-CA 123.703 0.801 . . . . 63.32 110.867 178.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.499 HG12 ' O ' ' A' ' 103' ' ' PHE . 38.5 mm -62.84 -49.55 83.2 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 CA-C-O 120.916 0.389 . . . . 74.15 110.715 170.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.7 -31.28 70.26 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 112.73 0.641 . . . . 70.11 112.73 175.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -80.63 -54.96 5.18 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.442 0.904 . . . . 75.42 113.442 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 48.1 t -112.63 -4.21 14.16 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.023 0.929 . . . . 33.21 113.02 -174.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 89.88 162.47 38.38 Favored Glycine 0 N--CA 1.474 1.211 0 CA-C-O 120.781 0.1 . . . . 70.43 113.301 -177.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -63.83 -36.22 83.18 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.097 0.559 . . . . 75.44 111.639 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 93.3 p -65.94 -33.24 75.37 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.083 0.553 . . . . 73.22 111.086 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -55.79 28.85 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 123.332 0.395 . . . . 62.22 112.8 174.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 45.8 tp -64.96 -36.63 85.0 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 112.12 0.415 . . . . 73.44 112.12 176.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 18.3 m -58.52 -42.12 87.0 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 123.221 0.608 . . . . 73.24 110.782 175.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -70.08 -41.25 74.34 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.795 0.438 . . . . 74.11 111.61 176.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 84.8 mt -59.71 -41.5 90.95 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 122.94 0.496 . . . . 61.11 111.79 176.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 81.3 mt -73.82 -38.71 64.47 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.692 0.797 . . . . 61.44 111.405 177.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.636 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 7.8 tpt -63.99 -33.9 76.78 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.488 0.715 . . . . 72.11 111.885 178.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.0 t -83.58 -33.49 25.39 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 112.136 0.421 . . . . 70.43 112.136 172.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.503 ' HG2' HD21 ' A' ' 85' ' ' LEU . 50.7 tp10 -57.69 -43.02 84.84 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.429 0.692 . . . . 72.15 111.496 177.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.402 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.1 m -60.94 -27.54 41.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.976 0 CA-C-O 119.214 -0.422 . . . . 74.53 111.597 175.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.4 mtm -80.63 -36.88 32.03 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 118.173 0.442 . . . . 64.33 110.985 -177.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.55 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 10.4 mmpt? -65.9 -31.58 72.6 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 121.436 0.636 . . . . 73.22 111.253 172.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 23.6 mt -77.43 -35.5 54.01 Favored 'General case' 0 C--O 1.212 -0.92 0 CA-C-N 115.441 -0.799 . . . . 73.25 111.225 173.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 -64.1 -31.07 72.13 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.849 0.46 . . . . 73.23 110.851 170.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 27.4 tptp -72.08 -45.62 59.98 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.409 0.684 . . . . 44.41 110.367 175.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 47.9 tptt -69.21 -35.07 75.82 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 112.11 0.411 . . . . 73.31 112.11 178.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.2 t -71.15 -39.27 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.114 0.566 . . . . 62.11 110.189 177.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.635 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.0 pt20 -69.99 -31.68 69.49 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 122.017 -0.427 . . . . 73.41 110.615 175.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -61.45 -37.74 84.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 124.281 1.032 . . . . 54.32 110.964 176.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.5 mt -87.18 -34.35 19.05 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 115.292 -0.867 . . . . 75.35 112.496 -176.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.635 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -73.28 -26.05 60.93 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 117.993 0.36 . . . . 74.54 110.946 175.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.01 -37.59 74.59 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.606 0.762 . . . . 42.54 111.778 171.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.42 ' HB2' HD11 ' B' ' 137' ' ' LEU . 40.5 mt -86.77 -39.99 15.41 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.44 -0.8 . . . . 63.34 110.524 179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.48 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.5 OUTLIER -59.58 -20.81 58.36 Favored 'General case' 0 CA--C 1.571 1.787 0 C-N-CA 123.991 0.916 . . . . 45.45 110.823 170.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 38.1 t -84.41 -44.84 13.32 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.455 0.702 . . . . 61.13 111.106 171.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 70.2 p -152.81 122.01 6.66 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.289 0.636 . . . . 74.34 111.185 -175.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.439 ' HD2' HD23 ' B' ' 137' ' ' LEU . 10.0 mtpm? -110.21 -164.13 0.9 Allowed 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.988 0.915 . . . . 71.41 111.022 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -69.66 -14.66 62.92 Favored 'General case' 0 CA--C 1.565 1.528 0 C-N-CA 125.098 1.359 . . . . 62.43 113.48 172.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 N--CA 1.496 1.864 0 C-N-CA 124.382 1.073 . . . . 73.44 112.63 -178.444 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.309 0 N-CA-C 113.687 0.235 . . . . 64.41 113.687 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 34.1 t -86.03 71.74 10.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.272 0.629 . . . . 74.14 111.472 179.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.5 t70 62.45 14.02 6.6 Favored 'General case' 0 N--CA 1.496 1.845 0 C-N-CA 124.878 1.271 . . . . 72.11 114.112 167.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 -58.42 -22.03 52.88 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.928 1.291 . . . . 75.11 113.871 -177.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -63.41 161.43 14.24 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.444 1.097 . . . . 72.3 111.789 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.2 t30 -124.31 103.54 8.28 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.726 -0.609 . . . . 64.42 110.062 175.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -161.03 158.87 28.58 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.552 0.741 . . . . 63.54 109.658 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.506 ' HA ' ' HA2' ' B' ' 72' ' ' GLY . 5.0 p-10 -64.31 -34.19 77.57 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.959 0.726 . . . . 72.04 112.959 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -57.84 -19.8 31.57 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.967 0.907 . . . . 73.53 113.076 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 52.1 t -44.8 -35.64 2.84 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.89 1.276 . . . . 72.12 113.284 174.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.528 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 42.8 m95 -57.03 -15.9 6.08 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 116.398 1.999 . . . . 73.23 116.398 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 74.7 m -43.74 -38.55 3.24 Favored 'General case' 0 N--CA 1.51 2.527 0 N-CA-C 114.236 1.199 . . . . 63.52 114.236 -176.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 98.3 t -70.06 -30.99 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.693 0 C-N-CA 124.055 0.942 . . . . 75.23 112.236 -179.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 97.6 mt -85.43 -38.73 18.32 Favored 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 123.644 0.778 . . . . 75.22 112.704 175.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 7.6 mm-40 -56.62 -48.04 78.35 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 113.936 1.087 . . . . 75.44 113.936 -169.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.64 -7.21 26.8 Favored Glycine 0 CA--C 1.542 1.763 0 N-CA-C 114.605 0.602 . . . . 65.25 114.605 178.144 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.7 m-85 -107.59 -2.18 20.52 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.668 0.787 . . . . 74.53 112.473 177.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 10.0 ptp180 -61.04 -24.52 66.25 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 118.863 0.756 . . . . 61.41 112.531 -175.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.9 p -51.49 -43.29 30.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.432 0 C-N-CA 123.463 0.705 . . . . 75.42 111.622 170.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.445 HG21 ' HE2' ' B' ' 93' ' ' LYS . 26.7 m -85.63 -39.48 17.25 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.698 0.799 . . . . 50.45 111.058 177.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.552 HD23 HD12 ' B' ' 90' ' ' LEU . 81.0 mt -58.99 -39.14 80.89 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.145 0.578 . . . . 75.42 111.645 -177.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.47 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 66.0 p -72.83 -33.3 66.09 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 113.412 0.893 . . . . 74.33 113.412 -179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 55.4 p -86.86 -22.83 25.53 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.792 0.664 . . . . 62.53 112.792 -178.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.76 HG11 HD21 ' B' ' 90' ' ' LEU . 67.1 t -97.58 -50.58 11.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 112.696 0.628 . . . . 51.11 112.696 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 73.7 mt -79.18 147.55 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-O 121.511 0.672 . . . . 71.23 112.799 -171.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.471 ' HB2' ' HE ' ' B' ' 29' ' ' ARG . 19.1 m-20 -121.99 105.35 37.6 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.749 0.819 . . . . 71.51 109.8 175.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.688 ' HA ' HG12 ' B' ' 30' ' ' ILE . 38.1 Cg_exo -58.5 -16.28 28.85 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.173 2.582 . . . . 75.24 113.462 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.7 m -66.39 -22.3 66.24 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.218 0.607 . . . . 60.45 110.784 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.471 ' HE ' ' HB2' ' B' ' 26' ' ' ASP . 10.6 ptp180 -96.95 -29.14 13.85 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 112.984 0.735 . . . . 72.33 112.984 175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.688 HG12 ' HA ' ' B' ' 27' ' ' PRO . 33.0 pt -99.06 -20.29 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.025 0 N-CA-C 114.071 1.137 . . . . 71.22 114.071 -171.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . . . . . . . . . 20.4 p -58.34 -41.59 90.23 Favored Pre-proline 0 N--CA 1.505 2.301 0 N-CA-C 114.257 1.206 . . . . 74.42 114.257 -177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -64.16 -30.72 65.11 Favored 'Trans proline' 0 C--N 1.393 2.914 0 CA-C-N 121.769 1.668 . . . . 72.33 113.173 174.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.474 ' HE1' ' HB3' ' B' ' 81' ' ' GLU . 21.3 t80 -70.27 -41.27 73.67 Favored 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 122.794 0.438 . . . . 74.21 110.546 174.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.36 -24.35 67.81 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.35 0.66 . . . . 71.5 112.256 175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.402 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 21.5 mmm180 -64.01 -44.12 93.58 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.615 0.766 . . . . 61.54 110.97 169.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.58 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.8 mm100 -59.23 -38.7 80.63 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.976 0.91 . . . . 70.3 112.014 178.817 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 60.5 m -73.09 -6.17 43.89 Favored 'General case' 0 CA--C 1.559 1.315 0 C-N-CA 123.646 0.778 . . . . 60.21 112.488 176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.605 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.0 mmtp 67.95 13.69 9.21 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.353 1.461 . . . . 61.23 113.694 173.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 15.9 m -93.69 -40.09 11.36 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 C-N-CA 122.896 0.478 . . . . 74.21 111.114 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.476 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.2 tt -88.33 118.1 27.71 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.878 0.871 . . . . 71.24 110.327 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -74.78 159.12 83.85 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.589 1.156 . . . . 70.21 111.449 177.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . 0.473 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 36.5 Cg_endo -61.27 -30.64 88.42 Favored 'Trans proline' 0 C--N 1.382 2.321 0 C-N-CA 121.879 1.719 . . . . 51.55 112.036 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -61.69 -39.99 93.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.177 0.991 . . . . 75.15 111.962 176.838 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.428 ' HB3' HG21 ' B' ' 67' ' ' ILE . 14.0 m-20 -64.12 -55.69 20.14 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.351 1.061 . . . . 54.02 111.487 -176.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.476 ' HB3' HD21 ' B' ' 40' ' ' LEU . 19.7 pt-20 -60.02 -32.7 71.13 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.861 -0.609 . . . . 70.22 112.098 176.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.473 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 24.0 mm-40 -66.13 -47.61 73.53 Favored 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.449 0.568 . . . . 73.52 111.762 175.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 -70.46 -31.05 68.04 Favored 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 111.968 0.358 . . . . 75.33 111.968 -177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 74.4 t -76.14 -39.61 36.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 CA-C-O 121.026 0.441 . . . . 70.14 110.942 174.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.4 mm? -86.78 22.26 2.01 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.583 0.753 . . . . 70.42 111.878 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -59.02 -33.52 70.84 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.911 0.863 . . . . 73.21 109.851 168.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -105.02 105.56 52.0 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 124.622 1.169 . . . . 71.51 108.188 161.439 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -61.57 -27.09 81.34 Favored 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 122.948 2.432 . . . . 74.43 112.936 175.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.407 ' HB2' HG23 ' B' ' 55' ' ' VAL . 13.4 m-80 -75.69 -176.77 3.43 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.787 0.835 . . . . 61.14 112.238 179.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.459 ' O ' ' HD2' ' B' ' 57' ' ' ARG . 40.3 mt -106.69 44.97 1.01 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 115.426 -0.806 . . . . 71.35 109.944 174.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.407 HG23 ' HB2' ' B' ' 53' ' ' ASN . 59.7 t -82.94 -55.98 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 O-C-N 122.063 -0.398 . . . . 75.11 110.56 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.426 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 46.4 pt -94.94 25.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.397 0 N-CA-C 112.798 0.666 . . . . 64.42 112.798 -176.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.459 ' HD2' ' O ' ' B' ' 54' ' ' LEU . 0.0 OUTLIER -49.02 -31.45 7.62 Favored 'General case' 0 N--CA 1.504 2.24 0 N-CA-C 114.231 1.197 . . . . 63.2 114.231 -178.289 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -60.44 -47.5 85.82 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.731 0.812 . . . . 72.25 111.536 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.426 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 8.1 ptp180 -81.94 -22.86 36.47 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.978 -0.451 . . . . 50.24 111.546 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.577 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 67.9 mttm -60.19 -57.13 14.11 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 122.949 0.5 . . . . 73.44 112.077 179.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.47 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 12.4 t -67.4 -34.99 72.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 110.317 -0.253 . . . . 64.31 110.317 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.37 -47.39 91.09 Favored Glycine 0 C--N 1.351 1.41 0 CA-C-N 116.031 -0.531 . . . . 73.31 112.915 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 22.2 m -75.27 -31.36 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.999 0 CA-C-O 119.425 -0.322 . . . . 74.11 111.175 175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.534 HD22 ' HB3' ' B' ' 27' ' ' PRO . 36.2 tp -61.64 -39.54 91.71 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.557 0.577 . . . . 71.32 112.557 -179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.528 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 14.2 mt -63.27 -42.93 99.19 Favored 'General case' 0 N--CA 1.484 1.274 0 CA-C-O 121.254 0.55 . . . . 54.2 110.25 175.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -65.52 -23.98 67.01 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.509 1.124 . . . . 72.41 112.019 175.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.428 HG21 ' HB3' ' B' ' 44' ' ' ASP . 54.8 mt -77.09 -56.28 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.042 0 C-N-CA 123.962 0.905 . . . . 64.02 111.096 174.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 81.4 mt -68.03 -27.21 66.34 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 122.939 0.496 . . . . 60.31 112.099 -174.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -66.95 -17.39 64.89 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.816 0.673 . . . . 73.42 112.816 175.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 38.8 mtp180 -61.4 -21.31 63.96 Favored 'General case' 0 N--CA 1.495 1.807 0 C-N-CA 123.663 0.785 . . . . 74.51 112.107 172.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 74.2 p -102.21 3.88 38.78 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.325 0.65 . . . . 74.33 111.817 174.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' B' ' 8' ' ' ASP . . . 74.16 -128.71 10.97 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 115.367 0.907 . . . . 31.24 115.367 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 62.0 t60 -65.46 -28.84 69.51 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.263 1.025 . . . . 73.1 110.89 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -52.12 -60.44 3.2 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.088 0.955 . . . . 60.23 112.147 173.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.1 -34.72 90.73 Favored Glycine 0 C--N 1.347 1.184 0 CA-C-N 116.12 -0.491 . . . . 75.03 114.033 178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.418 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 82.4 t80 -53.23 -63.95 0.98 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.563 0.745 . . . . 73.04 111.516 171.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.58 ' O ' ' HG2' ' B' ' 81' ' ' GLU . 89.9 t -61.97 -35.38 68.0 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.942 0 CA-C-N 115.768 -0.651 . . . . 54.22 111.026 -178.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.38 -42.25 99.28 Favored 'General case' 0 C--O 1.253 1.261 0 C-N-CA 123.39 0.676 . . . . 73.2 112.594 176.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -60.81 -40.61 93.37 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 116.055 -0.52 . . . . 74.22 109.699 173.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.443 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 27.9 mt -62.52 -39.7 94.4 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 123.309 0.38 . . . . 64.53 111.883 173.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.58 ' HG2' ' O ' ' B' ' 77' ' ' VAL . 8.7 mm-40 -54.54 -54.45 41.02 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.047 0.939 . . . . 75.12 110.956 177.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' B' ' 30' ' ' ILE . 97.1 p -67.11 -33.76 76.16 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-N 114.899 -1.046 . . . . 61.32 111.292 177.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 15.5 tp -71.72 -45.5 61.62 Favored 'General case' 0 C--O 1.205 -1.275 0 N-CA-C 112.679 0.622 . . . . 62.3 112.679 -175.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 36.6 mt-10 -68.84 -22.36 64.23 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 121.496 -0.753 . . . . 71.33 111.534 -176.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -84.64 -52.38 6.14 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 123.663 0.785 . . . . 71.22 110.385 176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 79.2 m-85 -88.88 -40.6 12.99 Favored 'General case' 0 N--CA 1.493 1.712 0 N-CA-C 114.743 1.386 . . . . 73.25 114.743 -174.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.512 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.1 m-85 -130.03 85.29 57.9 Favored Pre-proline 0 N--CA 1.502 2.147 0 CA-C-N 119.307 0.958 . . . . 64.1 112.092 178.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -71.93 -36.11 6.46 Favored 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.68 2.253 . . . . 74.21 113.288 -171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.455 ' HG3' HD22 ' B' ' 90' ' ' LEU . 15.5 pt20 -67.56 -33.3 74.77 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.501 0.72 . . . . 71.13 111.679 175.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.76 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -64.97 -36.04 83.11 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.629 0.372 . . . . 52.22 110.707 175.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.479 ' HA ' HG22 ' B' ' 94' ' ' VAL . 68.3 t80 -68.85 -48.67 62.9 Favored 'General case' 0 C--O 1.246 0.884 0 CA-C-O 120.68 0.276 . . . . 74.4 110.745 173.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -51.72 -39.09 57.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.733 0.813 . . . . 72.55 112.331 176.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.445 ' HE2' HG21 ' B' ' 20' ' ' THR . 0.0 OUTLIER -79.34 -46.94 16.7 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 119.103 -0.475 . . . . 65.4 112.169 178.809 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.479 HG22 ' HA ' ' B' ' 91' ' ' TYR . 33.9 m -60.8 -33.23 54.44 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.897 0 CA-C-N 118.798 0.727 . . . . 54.4 112.681 -177.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.504 ' HB ' ' HE3' ' B' ' 97' ' ' LYS . 71.7 p -95.14 -36.06 11.64 Favored 'General case' 0 N--CA 1.484 1.236 0 N-CA-C 112.08 0.4 . . . . 55.34 112.08 179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.14 -7.52 72.74 Favored Glycine 0 CA--C 1.539 1.594 0 CA-C-N 116.567 -0.288 . . . . 15.41 113.359 -177.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.504 ' HE3' ' HB ' ' B' ' 95' ' ' THR . 0.4 OUTLIER -131.32 177.54 7.4 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.614 0.765 . . . . 73.23 110.857 177.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 38.3 mm-40 -61.23 156.06 52.67 Favored Pre-proline 0 N--CA 1.488 1.433 0 N-CA-C 113.427 0.899 . . . . 72.23 113.427 -174.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -47.73 110.7 0.33 Allowed 'Trans proline' 0 C--N 1.381 2.259 0 C-N-CA 123.098 2.532 . . . . 64.31 114.02 169.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.07 -40.85 59.91 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.61 0.764 . . . . 42.12 110.7 -177.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.636 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 49.2 ttp180 74.74 56.1 0.08 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.329 1.452 . . . . 72.11 109.843 175.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.3 43.27 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.592 0 C-N-CA 124.1 0.96 . . . . 70.14 111.104 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.465 ' HA ' ' OE1' ' B' ' 81' ' ' GLU . 3.2 m-85 -67.74 4.35 1.15 Allowed 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 113.841 1.052 . . . . 71.32 113.841 -172.029 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.426 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 67.7 m -64.94 -18.37 65.18 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.136 0.974 . . . . 75.01 112.757 173.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 42.9 tpp -63.02 -61.58 2.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.8 0.44 . . . . 74.23 110.43 171.804 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -30.14 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.37 0.668 . . . . 62.44 111.134 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.466 HD12 ' HG2' ' B' ' 112' ' ' GLU . 34.4 mm -61.73 -49.85 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.87 -0.518 . . . . 65.34 111.313 171.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.63 -36.21 83.5 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.148 0.579 . . . . 64.34 111.978 176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.605 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -80.81 -61.69 1.89 Allowed 'General case' 0 CA--C 1.557 1.217 0 N-CA-C 113.53 0.937 . . . . 65.31 113.53 -172.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 40.8 t -95.73 -13.77 23.91 Favored 'General case' 0 N--CA 1.497 1.918 0 C-N-CA 123.451 0.701 . . . . 72.41 112.535 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.56 161.71 30.16 Favored Glycine 0 N--CA 1.477 1.399 0 CA-C-O 120.258 -0.19 . . . . 30.43 112.785 -176.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.466 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.4 mt-10 -64.59 -41.0 96.53 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 116.945 0.372 . . . . 51.55 110.879 174.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -65.7 -32.16 73.56 Favored 'General case' 0 N--CA 1.478 0.966 0 O-C-N 123.702 0.626 . . . . 54.41 111.04 174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.49 -54.49 37.34 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.255 0.347 . . . . 73.1 112.864 173.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.42 ' HA ' HD12 ' B' ' 118' ' ' LEU . 37.7 tp -66.24 -32.44 73.86 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.058 0.543 . . . . 74.52 112.073 176.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 40.5 m -63.55 -43.35 97.34 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.711 0.404 . . . . 73.05 110.243 175.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -63.19 -43.12 99.09 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.557 0.743 . . . . 72.04 111.19 175.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.58 HD11 ' HG3' ' B' ' 36' ' ' GLN . 88.5 mt -56.95 -62.5 1.7 Allowed 'General case' 0 N--CA 1.489 1.489 0 O-C-N 123.756 0.66 . . . . 60.3 111.084 176.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.596 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.1 mt -57.76 -43.3 85.38 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.658 0.783 . . . . 74.35 112.083 -179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.488 ' O ' HG22 ' B' ' 123' ' ' VAL . 11.0 tpt -59.4 -45.0 92.71 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 124.055 0.942 . . . . 74.41 112.403 178.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 8.9 t -69.93 -37.53 75.93 Favored 'General case' 0 N--CA 1.485 1.28 0 O-C-N 121.925 -0.485 . . . . 70.51 111.565 174.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 28.6 mm-40 -59.73 -37.51 79.15 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.655 0.382 . . . . 73.43 111.643 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.516 HG13 ' O ' ' B' ' 119' ' ' LEU . 3.9 m -69.63 -22.56 25.29 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 CA-C-N 117.879 0.308 . . . . 73.42 111.458 176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 38.1 mtm -79.14 -38.73 35.3 Favored 'General case' 0 N--CA 1.49 1.535 0 CA-C-O 121.063 0.459 . . . . 65.32 109.815 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -63.42 -38.86 92.78 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.123 0.969 . . . . 73.04 110.798 174.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.626 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 52.1 mt -73.17 -40.92 64.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.301 1.04 . . . . 53.42 111.939 177.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -61.0 -36.95 80.83 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.347 0.659 . . . . 62.14 110.287 174.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 53.6 tptt -70.35 -39.91 74.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.874 1.27 . . . . 74.31 110.341 173.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.448 ' HE3' HD21 ' B' ' 133' ' ' LEU . 45.8 tptt -66.01 -34.19 77.52 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.968 0.907 . . . . 42.42 111.903 -178.281 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.428 HG23 ' O ' ' B' ' 126' ' ' LEU . 66.2 t -62.12 -50.7 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 C-N-CA 122.884 0.473 . . . . 72.34 110.829 176.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.606 ' HA ' HG22 ' B' ' 134' ' ' THR . 11.5 pt20 -69.08 -30.48 68.8 Favored 'General case' 0 N--CA 1.485 1.297 0 O-C-N 122.135 -0.353 . . . . 70.51 111.155 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -62.32 -38.95 91.42 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 124.25 1.02 . . . . 72.22 110.802 176.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.448 HD21 ' HE3' ' B' ' 129' ' ' LYS . 10.8 mt -79.76 -46.28 17.3 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 116.126 -0.488 . . . . 71.32 110.936 -178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.606 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.7 t -64.55 -25.68 68.08 Favored 'General case' 0 N--CA 1.484 1.273 0 O-C-N 123.129 0.268 . . . . 62.33 111.456 179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.91 -48.98 72.22 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.354 0.662 . . . . 74.32 111.274 174.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.48 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.7 mt -77.02 -22.49 52.98 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.575 0.75 . . . . 71.32 111.657 179.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' B' ' 133' ' ' LEU . 2.0 tt -71.61 -48.3 48.93 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 125.053 1.341 . . . . 72.41 109.214 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.1 t -61.48 -25.48 67.28 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.448 1.099 . . . . 74.12 113.21 178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 66.5 p -141.88 95.76 2.86 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.174 0.59 . . . . 70.11 110.509 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -103.89 -170.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.62 0.768 . . . . 71.24 112.116 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -101.0 13.42 35.26 Favored 'General case' 0 CA--C 1.561 1.375 0 C-N-CA 123.609 0.764 . . . . 51.42 112.616 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.709 -0.662 . . . . 72.2 110.802 177.015 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.933 0 N-CA-C 112.917 -0.073 . . . . 74.14 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.8 t -173.89 144.76 1.06 Allowed 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 124.144 0.977 . . . . 73.52 110.525 -176.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -67.76 -29.74 69.03 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.04 0.536 . . . . 72.41 110.647 170.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -87.63 -67.28 0.83 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 124.184 0.994 . . . . 63.31 111.331 -175.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.1 mp0 -79.87 136.45 36.68 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 122.617 0.367 . . . . 54.42 111.7 -176.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.2 p30 53.71 -3.92 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.816 0 N-CA-C 117.801 2.519 . . . . 72.04 117.801 170.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 32.55 87.11 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 115.472 1.656 . . . . 73.33 115.472 -177.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -68.92 -15.83 63.59 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.568 0.747 . . . . 74.54 112.127 177.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -49.14 -33.67 12.53 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 125.165 1.386 . . . . 64.43 113.41 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 72.0 m -53.9 -36.43 62.71 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.123 0.969 . . . . 71.05 112.968 179.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 58.2 m95 -60.32 -17.61 44.14 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 115.157 1.54 . . . . 75.1 115.157 177.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.3 m -54.27 -32.45 56.25 Favored 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 118.527 0.603 . . . . 63.21 112.166 173.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.7 t -68.63 -34.71 66.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 C-N-CA 123.997 0.919 . . . . 74.31 111.46 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -85.6 -26.48 26.07 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.122 0.569 . . . . 72.25 111.912 174.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -58.1 -49.15 77.93 Favored 'General case' 0 N--CA 1.489 1.492 0 N-CA-C 113.31 0.856 . . . . 72.43 113.31 -174.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -66.99 -5.09 31.14 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.313 0.485 . . . . 74.12 114.313 176.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -111.39 -4.36 14.91 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.866 0.867 . . . . 71.22 111.853 175.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -53.78 -37.2 63.23 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 113.367 0.877 . . . . 61.45 113.367 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.5 p -63.02 -26.78 41.82 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.559 0 C-N-CA 123.03 0.532 . . . . 64.01 112.05 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.0 m -92.31 -40.84 10.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.568 0.747 . . . . 51.5 111.266 175.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.402 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.1 mt -59.45 -36.95 76.92 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 123.742 0.817 . . . . 63.34 111.509 179.539 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 57.4 p -72.65 -29.41 63.42 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.247 0.619 . . . . 74.21 112.277 176.692 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.615 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 33.7 t -76.15 -39.3 55.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.158 0.583 . . . . 71.13 111.912 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.427 ' HB ' HD12 ' A' ' 25' ' ' ILE . 66.1 t -90.88 -52.95 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 N-CA-C 113.401 0.889 . . . . 73.13 113.401 -173.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.437 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.8 mp -72.89 143.65 13.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.343 0 C-N-CA 123.178 0.591 . . . . 73.41 112.516 -168.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 7.2 t70 -107.07 111.87 63.37 Favored Pre-proline 0 C--O 1.253 1.254 0 C-N-CA 123.935 0.894 . . . . 72.35 110.249 176.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.522 ' O ' HG23 ' A' ' 31' ' ' THR . 74.7 Cg_exo -50.44 -35.85 46.62 Favored 'Trans proline' 0 C--N 1.384 2.408 0 C-N-CA 123.485 2.79 . . . . 65.41 113.191 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 40.8 t -67.71 -30.74 70.33 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-N 115.769 -0.651 . . . . 62.52 111.987 -173.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 13.4 ptp180 -88.78 -19.95 25.35 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 118.324 0.511 . . . . 75.22 111.646 -177.298 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 34.0 pt -95.13 -20.69 5.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 N-CA-C 112.362 0.505 . . . . 72.12 112.362 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 27' ' ' PRO . 22.4 p -53.09 -42.86 92.99 Favored Pre-proline 0 N--CA 1.505 2.312 0 CA-C-O 117.648 -1.168 . . . . 51.3 114.088 179.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -59.86 -45.87 22.53 Favored 'Trans proline' 0 C--N 1.4 3.287 0 C-N-CA 121.955 1.77 . . . . 64.4 112.887 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -67.04 -37.51 84.2 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.169 0.588 . . . . 71.14 112.401 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD13 HD21 ' A' ' 68' ' ' LEU . 87.4 mt -66.24 -36.03 81.96 Favored 'General case' 0 CA--C 1.565 1.532 0 C-N-CA 122.84 0.456 . . . . 74.13 111.748 174.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.5 mmm-85 -63.15 -48.94 76.31 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.674 0.79 . . . . 64.22 111.238 173.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.431 ' HB3' HD11 ' A' ' 106' ' ' ILE . 21.4 mm-40 -63.35 -33.17 74.94 Favored 'General case' 0 CA--C 1.559 1.301 0 C-N-CA 124.33 1.052 . . . . 72.24 111.932 178.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.481 ' SG ' ' HB ' ' A' ' 106' ' ' ILE . 97.3 m -76.14 -9.53 58.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.27 0.628 . . . . 74.01 111.603 172.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.426 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 70.6 mmtt 73.4 7.84 5.17 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 125.618 1.567 . . . . 73.31 112.625 174.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.4 m -85.49 -27.3 6.42 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.968 0 C-N-CA 123.793 0.837 . . . . 63.51 111.492 -179.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -99.92 135.05 41.92 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.684 0.794 . . . . 75.12 109.645 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.8 m-80 -114.06 156.87 43.47 Favored Pre-proline 0 N--CA 1.489 1.495 0 C-N-CA 124.46 1.104 . . . . 72.34 110.169 173.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -48.78 -37.6 35.94 Favored 'Trans proline' 0 C--N 1.387 2.592 0 C-N-CA 123.956 3.104 . . . . 54.23 116.513 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -69.79 -25.91 64.01 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 118.734 0.697 . . . . 73.22 112.376 -179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -66.49 -61.46 1.98 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.236 0.614 . . . . 74.43 111.884 177.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -52.34 -29.2 22.51 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 173.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -69.35 -53.04 21.56 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.248 0.619 . . . . 70.5 111.658 172.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -71.78 -29.78 64.83 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.26 0.467 . . . . 74.1 112.26 -173.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.7 -28.84 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 C-N-CA 124.22 1.008 . . . . 74.12 111.388 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -113.43 34.8 4.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.889 -0.507 . . . . 71.54 111.108 174.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -91.46 -35.48 14.31 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.398 0.888 . . . . 53.0 113.398 -177.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 71.9 m-20 -42.11 147.39 0.56 Allowed Pre-proline 0 N--CA 1.501 2.079 0 N-CA-C 113.709 1.003 . . . . 73.24 113.709 172.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -75.58 19.51 0.54 Allowed 'Trans proline' 0 C--N 1.376 1.992 0 C-N-CA 123.314 2.676 . . . . 74.43 113.748 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.557 ' HB2' HG23 ' A' ' 55' ' ' VAL . 31.3 p-10 -169.96 162.51 9.23 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 124.808 1.243 . . . . 71.45 110.586 -175.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -114.37 19.81 15.95 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.626 0.771 . . . . 73.21 110.426 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 53' ' ' ASN . 48.0 t -61.46 -30.42 48.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 C-N-CA 123.98 0.912 . . . . 63.23 110.84 172.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 1.4 pp -106.05 26.39 1.71 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.226 0 C-N-CA 125.244 1.418 . . . . 71.23 112.015 178.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 43.1 ttp180 -52.46 -22.99 5.36 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 113.396 0.887 . . . . 71.4 113.396 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.615 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 31.8 mmtp -53.31 -54.52 35.23 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.935 0.894 . . . . 65.41 111.807 172.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 11.6 ptm180 -69.24 -22.12 63.87 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.651 0.38 . . . . 74.31 111.995 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 67.3 mttm -65.64 -38.33 89.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.854 0.462 . . . . 55.22 111.419 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.467 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 20.6 t -66.21 -44.73 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 N-CA-C 109.478 -0.564 . . . . 52.03 109.478 174.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.55 -43.45 97.59 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 123.614 0.571 . . . . 34.04 114.168 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.6 m -71.14 -33.73 52.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 CA-C-N 116.915 0.357 . . . . 73.12 111.291 177.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.442 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 44.0 tp -70.18 -39.18 75.41 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.062 0.545 . . . . 75.04 111.755 177.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 80.7 mt -60.3 -45.93 91.64 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.063 0.545 . . . . 74.53 109.965 175.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.439 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 23.2 t70 -53.33 -46.34 69.42 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.164 0.986 . . . . 72.51 111.768 173.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 87.0 mt -55.8 -47.3 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 C-N-CA 123.566 0.747 . . . . 74.32 111.384 173.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 62.6 mt -69.27 -23.87 63.89 Favored 'General case' 0 CA--C 1.569 1.703 0 C-N-CA 122.925 0.49 . . . . 74.43 112.133 178.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.52 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.7 mt-30 -70.34 -27.66 64.53 Favored 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 123.641 0.776 . . . . 74.21 111.396 172.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 63.3 mtt180 -70.84 -18.85 62.7 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.25 0.62 . . . . 71.25 111.454 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 21.1 p -98.18 0.94 46.84 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.363 0.665 . . . . 34.32 110.926 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.68 -124.06 30.24 Favored Glycine 0 C--N 1.355 1.592 0 N-CA-C 115.3 0.88 . . . . 74.52 115.3 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.407 ' O ' HG23 ' A' ' 77' ' ' VAL . 8.9 t60 -67.79 -28.68 67.8 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.327 1.051 . . . . 75.22 110.543 -174.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -61.93 -54.39 42.49 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.111 0.564 . . . . 73.31 112.407 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.85 -34.55 90.14 Favored Glycine 0 N--CA 1.478 1.443 0 CA-C-N 116.176 -0.465 . . . . 61.24 113.214 177.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -54.34 -56.55 17.4 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 124.462 1.105 . . . . 63.03 111.615 171.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 73' ' ' HIS . 93.0 t -58.45 -46.54 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 C-N-CA 123.589 0.756 . . . . 52.11 111.786 177.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -56.68 -46.82 80.94 Favored 'General case' 0 N--CA 1.477 0.884 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.886 179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -67.12 -44.3 80.23 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-O 119.07 -0.49 . . . . 72.43 111.147 178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.499 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 90.7 mt -56.59 -52.98 62.78 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 112.822 0.675 . . . . 61.01 112.822 178.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.82 -39.31 90.73 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.739 0.816 . . . . 72.11 112.694 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 33.0 t -64.51 -38.14 90.0 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-O 121.631 0.729 . . . . 71.42 110.476 173.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.2 tp -70.46 -34.51 72.51 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.788 0.835 . . . . 75.23 111.1 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -60.9 -34.77 75.17 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-O 121.116 0.484 . . . . 74.2 111.212 176.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.447 ' HG ' HG21 ' B' ' 123' ' ' VAL . 5.8 tt -73.53 -57.09 4.24 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.698 0.799 . . . . 73.32 110.084 177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -78.71 -50.83 10.73 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 113.829 1.048 . . . . 74.13 113.829 -170.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.608 ' HB3' HD23 ' A' ' 90' ' ' LEU . 55.1 m-85 -133.0 81.18 58.28 Favored Pre-proline 0 N--CA 1.495 1.781 0 O-C-N 122.023 -0.423 . . . . 71.13 110.918 -179.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -60.46 -34.23 93.19 Favored 'Trans proline' 0 C--N 1.378 2.107 0 C-N-CA 123.17 2.58 . . . . 73.31 113.896 -173.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -67.46 -37.55 83.12 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.072 0.549 . . . . 71.11 112.163 177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.608 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.5 mm? -60.27 -42.45 95.44 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.277 0.631 . . . . 71.42 110.435 174.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.499 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 72.2 t80 -63.45 -51.59 65.05 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.228 -0.442 . . . . 73.1 111.533 175.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 14.4 mmmm -58.59 -31.73 68.31 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.056 0.761 . . . . 71.32 113.056 -178.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -79.82 -38.8 32.13 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 119.003 -0.523 . . . . 75.32 112.135 176.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.533 HG13 ' O ' ' A' ' 90' ' ' LEU . 14.9 m -65.39 -35.03 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 CA-C-N 119.014 0.825 . . . . 74.02 112.324 176.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 72.2 p -87.76 -45.61 10.19 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.1 0.56 . . . . 62.14 112.121 -178.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.06 -3.17 87.69 Favored Glycine 0 CA--C 1.545 1.94 0 N-CA-C 114.794 0.678 . . . . 42.33 114.794 -174.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.52 175.95 9.27 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.577 0.751 . . . . 71.11 111.435 178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.494 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 14.3 pt-20 -58.17 151.38 47.08 Favored Pre-proline 0 N--CA 1.497 1.903 0 C-N-CA 124.601 1.16 . . . . 74.21 113.001 -174.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 91' ' ' TYR . 38.4 Cg_exo -61.28 126.49 19.48 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.066 2.51 . . . . 62.32 114.142 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.96 -41.92 70.43 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 123.118 0.567 . . . . 62.45 110.378 176.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.507 ' NH1' ' SD ' ' B' ' 120' ' ' MET . 25.8 mmt85 67.4 51.81 0.85 Allowed 'General case' 0 N--CA 1.483 1.178 0 CA-C-N 114.858 -1.064 . . . . 71.13 110.908 174.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.9 t -82.72 44.64 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.544 0 C-N-CA 124.243 1.017 . . . . 74.43 111.187 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.422 ' O ' HG12 ' A' ' 107' ' ' ILE . 57.2 m-85 -61.63 -11.64 12.46 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.7 0.8 . . . . 74.41 112.182 173.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.439 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 34.7 t -61.5 -20.13 62.85 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.923 0.889 . . . . 62.55 111.007 173.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.3 tpt -57.2 -62.19 1.93 Allowed 'General case' 0 CA--C 1.554 1.098 0 C-N-CA 125.127 1.371 . . . . 63.44 112.118 169.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.549 HG23 HD22 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -72.21 -25.87 24.05 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.392 0.677 . . . . 63.32 110.746 -179.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.625 HD11 HG21 ' B' ' 116' ' ' THR . 37.0 mm -59.76 -47.31 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.275 0.63 . . . . 74.15 110.801 168.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -69.39 -40.92 77.1 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.174 0.59 . . . . 70.11 111.658 176.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.426 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -71.67 -49.56 38.63 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.672 0.789 . . . . 75.42 113.017 -172.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 41.8 t -107.32 -41.3 5.14 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.361 0.664 . . . . 33.21 112.446 -177.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.29 154.32 6.8 Favored Glycine 0 N--CA 1.476 1.357 0 CA-C-N 116.727 -0.215 . . . . 70.43 112.801 -175.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.444 ' HA ' HD12 ' A' ' 107' ' ' ILE . 50.5 mt-10 -58.78 -52.53 65.3 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.431 0.693 . . . . 75.44 111.077 174.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 68.1 p -60.96 -31.98 71.54 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.091 0.956 . . . . 73.22 112.364 177.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.79 -56.09 27.25 Favored Glycine 0 C--N 1.353 1.495 0 O-C-N 123.074 0.234 . . . . 62.22 112.651 175.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.549 HD22 HG23 ' A' ' 106' ' ' ILE . 31.5 tp -67.12 -29.05 68.68 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 122.878 0.471 . . . . 73.44 111.749 177.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 41.1 m -60.23 -47.24 86.81 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 122.727 0.411 . . . . 73.24 110.361 172.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -65.98 -39.91 90.75 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.658 0.783 . . . . 74.11 111.72 179.141 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.454 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.6 mt -57.51 -61.79 2.25 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.345 0.593 . . . . 61.11 110.678 173.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 94.7 mt -63.73 -24.59 67.83 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.649 0.78 . . . . 61.44 112.685 -176.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.483 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -75.22 -47.77 26.64 Favored 'General case' 0 C--N 1.36 1.05 0 CA-C-N 117.888 0.313 . . . . 72.11 110.881 174.829 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.9 t -64.42 -33.11 75.1 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 118.845 0.748 . . . . 70.43 110.941 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 18.1 mm-40 -62.23 -25.61 67.91 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-O 118.94 -0.553 . . . . 72.15 112.339 175.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 120' ' ' MET . 2.0 m -65.45 -30.56 50.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 CA-C-N 118.724 0.693 . . . . 74.53 110.388 174.084 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 52.7 mtm -79.2 -38.85 34.78 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.085 0.554 . . . . 64.33 110.057 -179.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -61.6 -38.61 88.21 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.143 0.977 . . . . 73.22 111.095 174.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.1 mt -78.35 -35.92 46.86 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.268 -0.878 . . . . 73.25 111.517 178.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -63.77 -29.99 71.14 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.003 0.521 . . . . 73.23 111.285 169.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 28.9 tptp -71.12 -48.83 49.84 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.407 0.683 . . . . 44.41 109.274 175.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.505 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.3 tptt -57.58 -41.98 82.22 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.66 0.784 . . . . 73.31 111.181 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.453 HG13 HD11 ' B' ' 133' ' ' LEU . 39.5 t -63.44 -47.81 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 124.131 0.972 . . . . 62.11 110.799 175.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -68.13 -29.81 68.81 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.473 0.309 . . . . 73.41 111.288 -175.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -69.6 -47.41 63.63 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 122.799 0.439 . . . . 54.32 111.152 175.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.532 HD13 ' HB ' ' B' ' 134' ' ' THR . 15.7 mt -71.14 -30.44 66.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.577 0.351 . . . . 75.35 111.634 -177.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.549 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.3 t -79.47 -30.11 41.99 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.666 0.387 . . . . 74.54 110.673 176.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.2 -43.89 97.82 Favored 'General case' 0 C--N 1.364 1.213 0 C-N-CA 122.809 0.443 . . . . 42.54 110.65 171.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 27.8 mt -69.77 -49.73 50.1 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 115.504 -0.771 . . . . 63.34 111.017 177.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.649 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.7 tt -50.75 -55.41 16.83 Favored 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 124.134 0.973 . . . . 45.45 111.316 176.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 29.8 t -68.87 -33.03 73.11 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.671 0.619 . . . . 61.13 112.671 -179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.7 m -134.4 92.69 2.95 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.225 0.61 . . . . 74.34 111.441 179.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -92.29 -178.7 5.02 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.176 0.59 . . . . 71.41 110.895 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -79.63 -6.23 56.68 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 112.722 0.638 . . . . 62.43 112.722 -178.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 19.0 t70 . . . . . 0 CA--C 1.562 1.417 0 C-N-CA 123.423 0.689 . . . . 73.44 109.706 174.972 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 CA-C-O 119.853 -0.415 . . . . 64.41 112.97 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.3 t -123.25 157.61 32.74 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.2 0.6 . . . . 74.14 112.504 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 77.2 m-20 -99.67 -178.76 3.98 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.644 0.778 . . . . 72.11 110.138 167.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -64.68 -61.49 2.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.042 0.537 . . . . 75.11 111.509 178.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -84.24 147.79 27.06 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.43 0.692 . . . . 72.3 109.732 171.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.659 HD22 ' H ' ' B' ' 6' ' ' ASN . 0.0 OUTLIER -75.92 75.04 2.84 Favored 'General case' 0 CA--C 1.565 1.535 0 CA-C-O 122.487 1.137 . . . . 64.42 111.0 174.171 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -86.75 110.04 19.64 Favored 'General case' 0 CA--C 1.563 1.456 0 CA-C-N 115.132 -0.94 . . . . 63.54 110.969 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -67.51 -12.91 61.45 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.488 0.715 . . . . 72.04 112.773 177.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -55.27 -34.3 63.94 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.397 1.079 . . . . 73.53 113.423 175.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 98.6 m -60.42 -26.32 66.63 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 113.103 0.779 . . . . 72.12 113.103 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 59.2 m95 -51.85 -32.17 30.8 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 113.532 0.938 . . . . 73.23 113.532 175.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.8 p -48.21 -36.77 14.4 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.319 1.048 . . . . 63.52 113.609 -178.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 86.4 t -56.35 -54.62 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 124.061 0.944 . . . . 75.23 111.724 177.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.613 ' HB3' HD11 ' B' ' 21' ' ' LEU . 81.6 mt -82.91 -28.04 30.23 Favored 'General case' 0 N--CA 1.482 1.17 0 CA-C-N 116.063 -0.517 . . . . 75.22 111.717 -179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -72.61 -29.07 63.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.8 0.84 . . . . 75.44 111.065 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.43 -20.12 36.25 Favored Glycine 0 CA--C 1.542 1.743 0 O-C-N 122.042 -0.411 . . . . 65.25 113.356 168.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 -120.35 23.52 10.85 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 124.493 1.117 . . . . 74.53 110.822 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 5.7 ppt_? -63.01 -26.16 68.72 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 112.276 0.472 . . . . 61.41 112.276 -177.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.7 p -64.4 -31.34 53.12 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 122.599 0.359 . . . . 75.42 111.5 174.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 29.0 m -77.71 -46.62 21.29 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.155 0.582 . . . . 50.45 110.318 173.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.613 HD11 ' HB3' ' B' ' 14' ' ' LEU . 94.7 mt -57.34 -37.31 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 N-CA-C 112.54 0.571 . . . . 75.42 112.54 177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 44.8 p -78.16 -26.66 47.83 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.201 0.601 . . . . 74.33 112.25 -178.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.703 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 60.3 p -83.95 -30.42 26.27 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.402 0.281 . . . . 62.53 111.403 179.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.724 HG11 HD21 ' B' ' 90' ' ' LEU . 57.6 t -90.95 -62.71 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 112.769 0.655 . . . . 51.11 112.769 179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.479 HD11 ' HG ' ' B' ' 90' ' ' LEU . 3.2 mp -73.01 128.37 35.71 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 122.888 0.475 . . . . 71.23 110.802 -169.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -96.15 125.87 46.45 Favored Pre-proline 0 N--CA 1.486 1.351 0 C-N-CA 123.637 0.775 . . . . 71.51 110.228 -179.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.561 ' HD3' HG22 ' B' ' 61' ' ' VAL . 31.6 Cg_exo -55.07 -37.02 94.18 Favored 'Trans proline' 0 C--N 1.388 2.654 0 C-N-CA 122.86 2.373 . . . . 75.24 112.299 -173.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.3 t -70.59 -27.71 64.32 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 115.792 -0.64 . . . . 60.45 112.059 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -95.13 2.5 55.11 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.739 0.644 . . . . 72.33 112.739 -177.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.4 pt -120.56 -25.32 2.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 N-CA-C 112.301 0.482 . . . . 71.22 112.301 174.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 9.0 p -52.88 -41.78 86.69 Favored Pre-proline 0 N--CA 1.496 1.853 0 CA-C-O 117.913 -1.041 . . . . 74.42 113.725 -178.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -58.74 -43.28 45.61 Favored 'Trans proline' 0 C--N 1.399 3.221 0 C-N-CA 121.791 1.661 . . . . 72.33 113.559 172.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.7 -36.27 78.25 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-O 121.026 0.441 . . . . 74.21 111.642 -178.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.69 -30.17 69.62 Favored 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 123.49 0.716 . . . . 71.5 111.956 174.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.411 ' HD2' ' O ' ' B' ' 40' ' ' LEU . 52.2 mmm-85 -65.52 -47.45 75.91 Favored 'General case' 0 N--CA 1.495 1.813 0 C-N-CA 123.424 0.689 . . . . 61.54 110.779 171.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.4 ' OE1' HD13 ' B' ' 118' ' ' LEU . 51.8 mt-30 -56.08 -38.48 70.75 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 124.597 1.159 . . . . 70.3 112.16 176.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 76.5 m -79.89 -5.95 56.51 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.912 0.885 . . . . 60.21 112.394 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.597 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.5 mmtt 70.57 16.2 6.98 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.077 1.351 . . . . 61.23 112.833 171.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.8 m -90.47 -37.47 9.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 122.954 0.502 . . . . 74.21 110.853 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -96.67 134.59 39.73 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.132 0.973 . . . . 71.24 109.162 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -99.69 154.58 37.19 Favored Pre-proline 0 N--CA 1.488 1.461 0 C-N-CA 124.011 0.924 . . . . 70.21 109.829 178.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -59.64 -13.42 21.54 Favored 'Trans proline' 0 C--N 1.38 2.209 0 C-N-CA 122.625 2.217 . . . . 51.55 113.892 -177.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -79.14 -44.43 22.01 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 124.824 1.25 . . . . 75.15 111.464 175.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.416 ' O ' ' HG3' ' B' ' 47' ' ' GLN . 63.6 m-20 -56.83 -63.2 1.28 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.829 0.851 . . . . 54.02 112.136 -176.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -42.06 -32.43 0.46 Allowed 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 114.721 1.378 . . . . 70.22 114.721 171.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -74.35 -48.31 28.87 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.694 0.398 . . . . 73.52 111.317 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.425 ' HA ' ' HB2' ' B' ' 50' ' ' SER . 0.0 OUTLIER -72.06 -28.57 63.42 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 111.999 0.37 . . . . 75.33 111.999 -176.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.504 HG21 HD13 ' B' ' 64' ' ' LEU . 70.1 t -61.41 -59.55 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.419 1.088 . . . . 70.14 111.117 170.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -85.18 18.95 2.37 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.222 0.609 . . . . 70.42 112.016 179.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . 0.425 ' HB2' ' HA ' ' B' ' 47' ' ' GLN . 40.7 t -60.64 -37.47 81.6 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.889 0.876 . . . . 73.21 112.062 -177.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 15.2 m-20 -79.75 108.75 9.73 Favored Pre-proline 0 CA--C 1.553 1.083 0 C-N-CA 123.423 0.689 . . . . 71.51 110.094 169.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.78 -43.26 45.51 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.84 2.36 . . . . 74.43 114.183 -178.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -48.56 124.09 7.69 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 113.475 0.917 . . . . 61.14 113.475 179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.655 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.7 pt? -72.76 -5.15 35.93 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 114.621 -1.172 . . . . 71.35 112.045 168.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 40.3 t -63.66 -41.28 92.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 C-N-CA 123.637 0.775 . . . . 75.11 111.031 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.542 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.1 pp -105.58 23.67 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.112 0 C-N-CA 124.278 1.031 . . . . 64.42 111.657 178.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.607 ' HA ' ' HE2' ' B' ' 60' ' ' LYS . 21.4 ttp180 -62.84 -27.91 69.66 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.716 0.635 . . . . 63.2 112.716 -176.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.703 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 27.7 mmtp -64.61 -41.55 96.12 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.659 0.384 . . . . 72.25 111.395 177.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.542 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 25.5 ptt180 -67.71 -30.75 70.33 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 122.153 -0.342 . . . . 50.24 110.831 177.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' B' ' 57' ' ' ARG . 51.7 mtmt -66.37 -28.84 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.855 0.462 . . . . 73.44 111.078 179.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.561 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.2 t -67.89 -41.86 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.263 0 N-CA-C 109.666 -0.494 . . . . 64.31 109.666 172.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -65.36 -39.43 95.85 Favored Glycine 0 C--N 1.351 1.364 0 CA-C-N 115.167 -0.924 . . . . 73.31 114.045 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 11.0 m -67.64 -32.54 57.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 CA-C-N 116.813 0.307 . . . . 74.11 110.303 176.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.504 HD13 HG21 ' B' ' 48' ' ' VAL . 41.1 tp -68.15 -40.11 82.47 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.359 0.664 . . . . 71.32 112.293 174.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.444 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 87.8 mt -57.69 -46.12 84.74 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 120.915 0.388 . . . . 54.2 110.315 175.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -56.19 -39.21 72.05 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 124.712 1.205 . . . . 72.41 112.111 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 51.2 mt -63.67 -47.54 90.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 C-N-CA 123.865 0.866 . . . . 64.02 111.943 174.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 84.0 mt -65.69 -23.47 66.78 Favored 'General case' 0 CA--C 1.563 1.471 0 C-N-CA 123.181 0.592 . . . . 60.31 111.459 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.444 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 77.4 mt-30 -72.14 -28.97 63.6 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.388 0.675 . . . . 73.42 112.722 169.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 mtp180 -63.6 -23.12 67.25 Favored 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 123.063 0.545 . . . . 74.51 112.345 177.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -90.88 9.32 30.88 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 123.295 0.638 . . . . 74.33 111.173 175.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 75.33 -131.77 12.6 Favored Glycine 0 C--N 1.349 1.279 0 CA-C-N 116.137 -0.483 . . . . 31.24 112.805 -175.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.481 ' O ' HG23 ' B' ' 77' ' ' VAL . 3.7 t60 -73.15 -24.58 60.59 Favored 'General case' 0 C--O 1.208 -1.1 0 C-N-CA 123.501 0.721 . . . . 73.1 109.946 174.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mtmt -51.95 -47.32 64.81 Favored 'General case' 0 N--CA 1.5 2.035 0 N-CA-C 113.402 0.89 . . . . 60.23 113.402 -173.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.08 -32.44 84.18 Favored Glycine 0 CA--C 1.531 1.086 0 CA-C-N 116.307 -0.406 . . . . 75.03 113.841 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.459 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 68.0 t80 -65.35 -42.3 92.99 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.842 0.857 . . . . 73.04 110.954 173.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.481 HG23 ' O ' ' B' ' 73' ' ' HIS . 14.7 t -57.18 -54.9 24.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 124.391 1.077 . . . . 54.22 109.833 175.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.89 -39.82 78.8 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 113.434 -1.712 . . . . 73.2 112.102 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -69.54 -36.41 76.34 Favored 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 122.602 0.361 . . . . 74.22 110.981 178.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 92.9 mt -60.69 -51.98 67.07 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.301 0.64 . . . . 64.53 111.671 173.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -67.59 -31.54 71.66 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.834 0.679 . . . . 75.12 112.834 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.2 m -65.52 -49.29 69.53 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.784 0.434 . . . . 61.32 110.564 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.78 -48.79 62.76 Favored 'General case' 0 C--O 1.205 -1.277 0 C-N-CA 123.316 0.646 . . . . 62.3 111.004 -171.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -54.31 -33.48 58.92 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.978 0.911 . . . . 71.33 112.093 178.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -79.48 -54.78 5.58 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.902 0.881 . . . . 71.22 110.621 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -81.26 -59.98 2.44 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.613 0.765 . . . . 73.25 112.755 -176.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.663 ' HB3' HD23 ' B' ' 90' ' ' LEU . 81.7 m-85 -123.75 70.75 48.69 Favored Pre-proline 0 N--CA 1.499 1.999 0 N-CA-C 112.766 0.654 . . . . 64.1 112.766 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -61.35 -32.69 89.68 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 122.206 1.937 . . . . 74.21 112.523 -179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -56.51 -32.39 65.0 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 124.414 1.086 . . . . 71.13 112.494 179.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.724 HD21 HG11 ' B' ' 24' ' ' VAL . 3.6 mm? -61.6 -56.34 20.9 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.787 0.835 . . . . 52.22 111.197 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.447 ' HA ' HG22 ' B' ' 94' ' ' VAL . 55.4 t80 -62.22 -43.15 99.49 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 120.911 0.386 . . . . 74.4 111.015 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -51.68 -50.26 60.78 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 115.116 -0.947 . . . . 72.55 112.905 176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.526 ' HE2' ' HA ' ' B' ' 90' ' ' LEU . 61.9 pttt -77.11 -36.21 55.73 Favored 'General case' 0 N--CA 1.485 1.317 0 N-CA-C 112.785 0.661 . . . . 65.4 112.785 -177.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.583 HG23 HG23 ' B' ' 95' ' ' THR . 20.8 m -67.62 -48.74 75.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 CA-C-N 118.604 0.638 . . . . 54.4 112.081 -178.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.583 HG23 HG23 ' B' ' 94' ' ' VAL . 44.4 p -91.22 -40.23 11.65 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 112.884 0.698 . . . . 55.34 112.884 -178.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.09 -12.46 22.06 Favored Glycine 0 N--CA 1.478 1.44 0 CA-C-N 116.35 -0.386 . . . . 15.41 113.389 -175.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 178.81 7.0 Favored 'General case' 0 N--CA 1.488 1.443 0 CA-C-N 117.623 0.711 . . . . 73.23 112.365 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -77.19 154.58 82.37 Favored Pre-proline 0 N--CA 1.487 1.402 0 C-N-CA 125.04 1.336 . . . . 72.23 110.632 176.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -60.18 -79.83 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.402 2.068 . . . . 64.31 113.38 175.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.491 ' HB3' HG23 ' B' ' 102' ' ' VAL . . . 170.66 -23.52 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.363 0 C-N-CA 124.003 0.921 . . . . 42.12 111.644 -175.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 93.4 mtt180 75.76 38.69 0.35 Allowed 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 125.639 1.575 . . . . 72.11 111.582 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.491 HG23 ' HB3' ' B' ' 100' ' ' ALA . 3.2 t -82.87 51.81 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.558 1.266 0 C-N-CA 124.375 1.07 . . . . 70.14 111.689 -178.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.407 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.0 m-85 -54.16 -5.0 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 114.415 1.265 . . . . 71.32 114.415 173.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 44.6 t -55.08 -19.77 8.1 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.986 1.315 . . . . 75.01 113.241 178.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.4 tpt -64.88 -63.13 1.19 Allowed 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.083 0.553 . . . . 74.23 110.939 172.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.628 HD12 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -66.2 -26.2 37.49 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.478 0 C-N-CA 123.823 0.849 . . . . 62.44 110.71 -179.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' B' ' 112' ' ' GLU . 39.3 mm -68.98 -49.85 59.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.132 0.573 . . . . 65.34 110.997 172.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -62.0 -33.87 75.14 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.009 0.524 . . . . 64.34 111.631 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.597 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -76.24 -52.66 9.55 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.948 0.899 . . . . 65.31 112.913 -177.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 59.9 p -107.46 -39.91 5.51 Favored 'General case' 0 N--CA 1.502 2.155 0 N-CA-C 112.717 0.636 . . . . 72.41 112.717 -176.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.73 162.52 10.29 Favored Glycine 0 N--CA 1.483 1.819 0 C-N-CA 123.032 0.349 . . . . 30.43 112.948 -176.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.63 ' HA ' HD12 ' B' ' 107' ' ' ILE . 49.0 mt-10 -65.51 -57.34 8.48 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 122.922 0.489 . . . . 51.55 110.019 171.54 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 79.9 p -63.49 -25.84 68.44 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.63 -0.714 . . . . 54.41 111.373 173.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.71 -59.44 10.53 Favored Glycine 0 C--N 1.354 1.541 0 O-C-N 123.17 0.293 . . . . 73.1 112.441 171.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.628 HD13 HD12 ' B' ' 106' ' ' ILE . 59.2 tp -62.25 -31.62 72.21 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.072 0.549 . . . . 74.52 111.379 176.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.625 HG21 HD11 ' A' ' 107' ' ' ILE . 34.9 m -56.94 -52.24 66.0 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.579 0.752 . . . . 73.05 111.167 172.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -64.67 -37.92 89.23 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.24 0.616 . . . . 72.04 111.325 179.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 115' ' ' LEU . 46.2 mt -64.18 -42.66 96.6 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.7 0.8 . . . . 60.3 111.689 175.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 88.7 mt -70.99 -30.38 66.62 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.208 0.603 . . . . 74.35 111.064 176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.536 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -70.23 -42.5 72.19 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.82 0.448 . . . . 74.41 110.341 178.146 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -70.54 -32.94 70.58 Favored 'General case' 0 N--CA 1.482 1.155 0 O-C-N 121.673 -0.642 . . . . 70.51 110.854 174.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.39 -28.21 68.04 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.594 0.59 . . . . 73.43 112.594 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 120' ' ' MET . 2.2 m -64.87 -31.4 53.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 CA-C-N 118.878 0.763 . . . . 73.42 110.028 173.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.2 mtm -80.14 -33.84 38.22 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.045 0.538 . . . . 65.32 110.419 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -60.31 -39.93 88.73 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.805 0.842 . . . . 73.04 110.939 172.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.572 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 39.6 mt -77.3 -33.91 55.6 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 114.566 -1.197 . . . . 53.42 111.4 176.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.4 mm-40 -67.38 -28.42 67.93 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 122.948 0.499 . . . . 62.14 111.329 171.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 51.2 tptt -70.85 -50.76 31.82 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.633 0.773 . . . . 74.31 109.309 174.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.1 tptm -56.33 -52.42 64.62 Favored 'General case' 0 CA--C 1.559 1.318 0 CA-C-N 115.307 -0.861 . . . . 42.42 111.271 177.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 33.7 t -54.23 -54.78 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 C-N-CA 124.73 1.212 . . . . 72.34 111.946 -179.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -65.58 -35.72 81.66 Favored 'General case' 0 N--CA 1.478 0.973 0 CA-C-N 116.508 -0.314 . . . . 70.51 111.287 -177.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -73.15 -23.64 60.48 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 122.613 0.365 . . . . 72.22 111.622 178.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.0 mt -77.4 -46.89 21.3 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 109.923 -0.399 . . . . 71.32 109.923 174.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 133' ' ' LEU . 1.9 t -65.64 -26.66 67.91 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 122.955 0.159 . . . . 62.33 110.892 175.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.31 -53.45 43.6 Favored 'General case' 0 C--N 1.36 1.024 0 C-N-CA 123.825 0.85 . . . . 74.32 110.556 175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.649 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -70.72 -25.7 63.06 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 122.823 0.449 . . . . 71.32 111.411 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.1 tt -66.02 -49.97 65.89 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 124.323 1.049 . . . . 72.41 109.154 176.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 98.6 p -73.78 -19.07 60.88 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.064 0.946 . . . . 74.12 112.181 176.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 20.5 t -114.56 32.94 5.63 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.701 0.8 . . . . 70.11 111.372 -178.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -72.88 168.44 18.9 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 122.192 -0.318 . . . . 71.24 110.274 169.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.96 -26.81 69.0 Favored 'General case' 0 N--CA 1.49 1.536 0 CA-C-O 121.158 0.504 . . . . 51.42 110.762 -179.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 . . . . . 0 CA--C 1.577 1.982 0 C-N-CA 124.263 1.025 . . . . 72.2 111.111 172.812 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.076 0 CA-C-O 120.118 -0.268 . . . . 74.14 113.058 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.2 t -151.3 -179.89 7.74 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.78 0.832 . . . . 73.52 110.174 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -67.76 150.45 48.63 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.226 0.61 . . . . 72.41 111.698 171.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 99.9 m-85 -75.19 -72.43 0.3 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.763 0.825 . . . . 63.31 111.64 -176.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -68.35 157.62 35.28 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.686 0.394 . . . . 54.42 110.529 172.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -74.27 82.04 1.85 Allowed 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.495 0.554 . . . . 72.04 112.495 -172.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -69.6 94.39 0.77 Allowed 'General case' 0 C--N 1.352 0.715 0 N-CA-C 107.436 -1.32 . . . . 73.33 107.436 169.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.49 ' HA ' ' SG ' ' A' ' 10' ' ' CYS 0.331 84.1 m-20 -89.03 -6.81 56.9 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 115.491 1.663 . . . . 74.54 115.491 174.732 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -56.49 -20.84 22.16 Favored 'General case' 0 CA--C 1.568 1.644 0 O-C-N 123.257 0.348 . . . . 64.43 111.008 157.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.49 ' SG ' ' HA ' ' A' ' 8' ' ' ASP . 21.9 p -50.25 -46.42 54.86 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.051 1.341 . . . . 71.05 112.917 167.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.454 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 67.7 m95 -46.86 -30.35 2.46 Favored 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 113.803 1.038 . . . . 75.1 113.803 177.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -52.23 -30.55 28.07 Favored 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 123.693 0.797 . . . . 63.21 112.638 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 53.6 t -53.45 -48.76 57.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 C-N-CA 124.673 1.189 . . . . 74.31 111.799 170.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.5 mt -82.22 -40.23 21.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.176 0.59 . . . . 72.25 112.096 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.48 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 6.2 mm-40 -50.94 -54.63 22.52 Favored 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 123.923 0.889 . . . . 72.43 111.767 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.67 -11.73 37.4 Favored Glycine 0 CA--C 1.54 1.641 0 N-CA-C 115.276 0.87 . . . . 74.12 115.276 178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 86.0 m-85 -118.4 8.65 12.2 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 117.749 0.775 . . . . 71.22 112.131 177.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 56.4 mtt180 -55.38 -37.55 67.7 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 112.885 0.698 . . . . 61.45 112.885 -179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -54.84 -33.72 29.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.428 0 C-N-CA 123.428 0.691 . . . . 64.01 112.064 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 m -87.9 -45.56 10.16 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.6 0.76 . . . . 51.5 111.13 176.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.462 HD23 HD12 ' A' ' 90' ' ' LEU . 95.5 mt -60.93 -45.53 94.31 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.882 0.873 . . . . 63.34 111.969 -174.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.633 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 66.6 p -67.21 -33.32 75.11 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 122.85 0.46 . . . . 74.21 111.901 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.9 t -75.11 -34.48 61.71 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.688 0.625 . . . . 71.13 112.688 179.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG11 HD21 ' A' ' 90' ' ' LEU . 73.4 t -88.8 -52.78 10.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 N-CA-C 113.164 0.801 . . . . 73.13 113.164 -175.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.426 ' HA ' ' CE1' ' A' ' 87' ' ' TYR . 2.1 mp -71.97 145.78 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 C-N-CA 123.624 0.77 . . . . 73.41 112.778 -166.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.456 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 11.7 m-20 -107.83 110.18 62.39 Favored Pre-proline 0 C--O 1.247 0.949 0 C-N-CA 123.312 0.645 . . . . 72.35 109.546 168.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.704 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 85.9 Cg_exo -53.09 -25.0 27.35 Favored 'Trans proline' 0 C--N 1.369 1.622 0 C-N-CA 122.446 2.098 . . . . 65.41 112.846 174.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 32.3 t -72.8 -29.5 63.32 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 124.13 0.972 . . . . 62.52 111.412 -176.043 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 10.1 ptp180 -85.26 -31.07 23.31 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 122.3 -0.25 . . . . 75.22 110.731 -177.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.6 pt -89.9 -3.36 10.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.042 0.537 . . . . 72.12 112.226 -178.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.603 HG23 ' O ' ' A' ' 27' ' ' PRO . 36.5 p -54.58 -48.78 94.23 Favored Pre-proline 0 N--CA 1.498 1.943 0 CA-C-O 117.51 -1.233 . . . . 51.3 113.663 177.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.447 ' HB2' HD22 ' A' ' 118' ' ' LEU . 44.4 Cg_endo -62.72 -34.9 71.96 Favored 'Trans proline' 0 C--N 1.402 3.379 0 CA-C-N 122.034 1.762 . . . . 64.4 112.599 -177.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -66.74 -55.3 15.63 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.625 0.77 . . . . 71.14 110.275 177.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 82.5 mt -63.65 -29.13 70.41 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.481 0.712 . . . . 74.13 112.662 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -56.77 -58.45 8.06 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.984 0.913 . . . . 64.22 110.424 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -69.18 -19.85 63.99 Favored 'General case' 0 CA--C 1.561 1.379 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.788 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -74.05 -10.16 59.35 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.183 0.593 . . . . 74.01 112.114 172.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 11.6 mmpt? 71.38 8.64 6.36 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.812 1.245 . . . . 73.31 112.716 175.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.464 HG12 ' HB3' ' A' ' 74' ' ' LYS . 20.1 m -94.26 -31.42 4.41 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.463 0.705 . . . . 63.51 110.982 -179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 7.4 tt -94.97 123.26 38.35 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.56 0.744 . . . . 75.12 110.244 179.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -97.9 148.65 34.77 Favored Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 124.698 1.199 . . . . 72.34 109.193 171.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -50.08 -27.6 17.3 Favored 'Trans proline' 0 C--N 1.385 2.458 0 C-N-CA 123.377 2.718 . . . . 54.23 114.879 -178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -63.12 -44.0 96.84 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.084 0.954 . . . . 73.22 111.783 175.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -60.36 -64.28 1.01 Allowed 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.728 0.811 . . . . 74.43 111.66 -178.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -50.68 -40.46 53.82 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 113.965 1.098 . . . . 71.35 113.965 176.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -71.59 -35.89 70.68 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 118.713 0.688 . . . . 70.5 111.434 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -76.33 -39.53 53.78 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-N 118.679 0.672 . . . . 74.1 111.515 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.0 t -68.42 -40.4 82.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.426 0.69 . . . . 74.12 110.955 179.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -102.04 25.91 8.21 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.645 0.778 . . . . 71.54 111.532 176.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 47.3 t -58.49 -33.41 69.77 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-O 121.719 0.771 . . . . 53.0 110.59 168.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -108.45 126.05 30.46 Favored Pre-proline 0 CA--C 1.568 1.648 0 C-N-CA 124.958 1.303 . . . . 73.24 109.242 170.191 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -80.12 -26.29 4.41 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 C-N-CA 122.656 2.237 . . . . 74.43 115.8 -170.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -61.5 144.51 54.12 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.817 1.043 . . . . 71.45 113.817 -170.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.5 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -83.59 -7.97 59.41 Favored 'General case' 0 N--CA 1.482 1.16 0 CA-C-N 115.392 -0.822 . . . . 73.21 110.666 173.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 t -65.69 -30.87 51.43 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 CA-C-O 121.572 0.701 . . . . 63.23 110.685 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.6 pt -105.44 24.39 2.21 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 124.719 1.207 . . . . 71.23 112.3 -177.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.454 ' HB3' ' O ' ' A' ' 22' ' ' THR . 85.6 mtt180 -48.83 -36.56 17.12 Favored 'General case' 0 N--CA 1.5 2.029 0 C-N-CA 123.646 0.778 . . . . 71.4 112.602 172.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -58.98 -47.27 85.75 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.109 0.964 . . . . 65.41 112.21 -171.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -76.76 -36.84 56.8 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.155 0.582 . . . . 74.31 111.566 173.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.704 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.6 ttmm -64.2 -55.35 22.31 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.189 1.395 . . . . 55.22 113.356 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.633 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 22.0 t -65.28 -31.8 55.44 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 O-C-N 122.239 -0.288 . . . . 52.03 110.341 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.83 -42.27 99.71 Favored Glycine 0 C--N 1.351 1.4 0 O-C-N 123.334 0.397 . . . . 34.04 114.069 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.6 m -72.65 -31.73 38.35 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.369 0 CA-C-N 116.865 0.332 . . . . 73.12 111.178 176.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.547 HD22 ' HB3' ' A' ' 27' ' ' PRO . 46.6 tp -64.39 -43.23 95.09 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.001 0.52 . . . . 75.04 111.314 172.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.507 ' O ' ' HG3' ' A' ' 69' ' ' GLN . 97.1 mt -58.84 -43.62 90.79 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.114 0.566 . . . . 74.53 110.726 177.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -58.23 -42.13 85.66 Favored 'General case' 0 CA--C 1.565 1.53 0 C-N-CA 124.103 0.961 . . . . 72.51 110.915 175.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.544 HG12 HH21 ' A' ' 70' ' ' ARG . 71.1 mt -60.69 -43.01 94.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 124.227 1.011 . . . . 74.32 111.924 173.181 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.476 HD13 ' HB2' ' A' ' 79' ' ' PHE . 95.5 mt -70.36 -29.41 66.08 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.333 0.653 . . . . 74.43 111.194 -177.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.507 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 50.6 mt-30 -71.05 -24.3 62.31 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 122.878 0.471 . . . . 74.21 111.644 173.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.544 HH21 HG12 ' A' ' 67' ' ' ILE . 47.7 mtm105 -65.76 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.726 0.41 . . . . 71.25 111.649 175.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 72.6 p -84.91 -7.79 59.03 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 122.607 0.363 . . . . 34.32 111.655 173.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 81.41 -129.93 9.37 Favored Glycine 0 C--N 1.351 1.367 0 N-CA-C 114.093 0.397 . . . . 74.52 114.093 -179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 20.5 t60 -70.05 -21.68 63.14 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.023 0.929 . . . . 75.22 111.381 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.464 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.1 mmmt -52.94 -63.83 1.02 Allowed 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 124.457 1.103 . . . . 73.31 111.759 173.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.27 -33.65 85.2 Favored Glycine 0 CA--C 1.533 1.167 0 CA-C-N 116.282 -0.417 . . . . 61.24 113.616 -179.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.5 t80 -53.73 -64.84 0.7 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.961 0.904 . . . . 63.03 112.177 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 99.5 t -60.1 -41.53 86.8 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 C-N-CA 123.018 0.527 . . . . 52.11 111.58 -178.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.68 80.5 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 123.307 0.643 . . . . 75.13 112.003 177.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.476 ' HB2' HD13 ' A' ' 68' ' ' LEU . 81.7 t80 -64.03 -43.54 95.25 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 122.805 0.442 . . . . 72.43 110.865 177.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.402 ' HB3' ' CE1' ' A' ' 91' ' ' TYR . 88.8 mt -55.33 -52.87 62.08 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 113.06 0.763 . . . . 61.01 113.06 177.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -80.61 -24.35 39.15 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 112.179 0.437 . . . . 72.11 112.179 -172.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 94.7 p -68.73 -39.26 80.48 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 109.733 -0.469 . . . . 71.42 109.733 164.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 20.8 tp -65.99 -34.36 77.93 Favored 'General case' 0 C--O 1.214 -0.787 0 C-N-CA 123.45 0.7 . . . . 75.23 111.578 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.406 ' HG2' ' HB3' ' A' ' 99' ' ' PRO . 1.4 tm-20 -54.57 -47.37 73.38 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 121.851 0.834 . . . . 74.2 109.97 173.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.455 HD21 ' HG2' ' A' ' 122' ' ' GLU . 6.3 tt -70.25 -53.44 16.93 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-N 114.28 -1.327 . . . . 73.32 110.929 -176.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -84.37 -48.12 10.01 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.235 1.198 . . . . 74.13 114.235 -171.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.604 ' HB3' HD23 ' A' ' 90' ' ' LEU . 88.3 m-85 -129.58 76.99 77.89 Favored Pre-proline 0 N--CA 1.496 1.871 0 CA-C-N 118.545 0.611 . . . . 71.13 110.596 178.236 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -59.68 -34.78 96.17 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 123.226 2.617 . . . . 73.31 114.267 -170.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.8 pt20 -71.4 -28.31 63.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.292 0.637 . . . . 71.11 112.288 178.288 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.604 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -68.94 -42.16 77.1 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.04 0.536 . . . . 71.42 110.367 174.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.402 ' CE1' ' HB3' ' A' ' 80' ' ' LEU . 19.4 t80 -63.83 -47.48 80.61 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.207 0.603 . . . . 73.1 110.837 175.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -51.99 -51.66 55.77 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.924 0.89 . . . . 71.32 112.404 172.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.517 ' HD3' HD13 ' A' ' 90' ' ' LEU . 20.2 ptmt -70.44 -37.31 74.34 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.579 0.585 . . . . 75.32 112.579 -174.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 28.2 m -66.93 -45.74 86.62 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 CA-C-N 118.22 0.464 . . . . 74.02 111.284 177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 71.1 p -75.15 -34.53 61.63 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.018 0.377 . . . . 62.14 112.018 -177.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.99 -20.26 46.88 Favored Glycine 0 N--CA 1.477 1.426 0 C-N-CA 123.267 0.46 . . . . 42.33 113.84 -178.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -122.57 -178.18 3.84 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 71.11 110.062 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -61.41 150.97 78.74 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 123.01 0.524 . . . . 74.21 111.185 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.406 ' HB3' ' HG2' ' A' ' 84' ' ' GLU . 55.6 Cg_exo -45.75 124.21 6.73 Favored 'Trans proline' 0 C--N 1.372 1.781 0 C-N-CA 123.663 2.909 . . . . 62.32 115.235 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.57 65.09 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.756 0.422 . . . . 62.45 110.024 176.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 69.37 53.45 0.43 Allowed 'General case' 0 N--CA 1.473 0.723 0 O-C-N 124.561 1.163 . . . . 71.13 110.952 177.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 10.0 t -79.62 46.25 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.774 0 C-N-CA 124.879 1.272 . . . . 74.43 110.478 176.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.421 ' O ' HG12 ' A' ' 107' ' ' ILE . 8.6 m-85 -61.6 -7.42 3.29 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 124.23 1.012 . . . . 74.41 112.333 176.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.481 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 78.1 p -62.28 -19.43 63.24 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 123.667 0.787 . . . . 62.55 110.851 171.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 14.4 tpt -53.99 -64.13 0.93 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.394 1.078 . . . . 63.44 111.289 169.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.469 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.13 -33.4 54.7 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 123.549 0.74 . . . . 63.32 110.739 -178.659 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 104' ' ' SER . 37.1 mm -56.34 -61.31 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 C-N-CA 123.321 0.648 . . . . 74.15 111.176 174.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.91 -20.39 60.41 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.264 0.626 . . . . 70.11 112.442 -176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -66.05 -58.25 5.9 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.069 0.548 . . . . 75.42 112.422 174.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.7 t -118.91 -39.67 2.93 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 112.387 0.514 . . . . 33.21 112.387 -172.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 147.52 155.76 6.72 Favored Glycine 0 CA--C 1.531 1.074 0 CA-C-N 116.676 -0.238 . . . . 70.43 113.261 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.417 ' HG2' HG23 ' A' ' 107' ' ' ILE . 44.7 mt-10 -61.1 -48.41 81.82 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.707 0.803 . . . . 75.44 111.769 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 87.7 p -61.54 -26.41 67.92 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.391 0.677 . . . . 73.22 111.983 175.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.36 -55.14 31.78 Favored Glycine 0 C--N 1.353 1.489 0 N-CA-C 112.687 -0.165 . . . . 62.22 112.687 171.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.469 ' HB2' HD12 ' A' ' 106' ' ' ILE . 32.0 tp -62.37 -34.72 77.24 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.972 0.509 . . . . 73.44 111.47 174.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.426 ' O ' ' HB2' ' A' ' 120' ' ' MET . 90.9 m -57.98 -44.95 87.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.537 0.735 . . . . 73.24 110.618 174.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -68.83 -40.84 79.25 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.345 0.658 . . . . 74.11 112.345 177.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.447 HD22 ' HB2' ' A' ' 32' ' ' PRO . 85.3 mt -56.82 -50.48 72.26 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.309 0.576 . . . . 61.11 111.407 175.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 83.1 mt -67.55 -37.72 83.12 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 114.952 -1.022 . . . . 61.44 111.744 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.426 ' HB2' ' O ' ' A' ' 116' ' ' THR . 0.0 OUTLIER -62.76 -41.0 99.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 123.625 0.77 . . . . 72.11 110.964 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -78.19 -33.65 49.96 Favored 'General case' 0 CA--C 1.553 1.059 0 O-C-N 122.102 -0.374 . . . . 70.43 111.927 174.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.455 ' HG2' HD21 ' A' ' 85' ' ' LEU . 20.0 tp10 -63.34 -37.01 85.62 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.04 0.536 . . . . 72.15 112.045 179.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.444 HG13 ' O ' ' A' ' 119' ' ' LEU . 18.4 m -66.13 -22.06 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 CA-C-O 119.225 -0.416 . . . . 74.53 111.327 174.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 68.3 mtm -80.25 -40.87 26.13 Favored 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 109.935 -0.394 . . . . 64.33 109.935 176.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -58.63 -41.41 85.87 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.244 0.617 . . . . 73.22 111.039 172.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 29.4 mt -77.12 -35.92 55.93 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.989 0.915 . . . . 73.25 111.717 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -61.5 -38.93 89.12 Favored 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 123.308 0.643 . . . . 73.23 110.969 173.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.2 tptp -74.55 -41.55 60.36 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 115.254 -0.885 . . . . 44.41 110.058 177.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.459 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 23.3 tptm -56.51 -46.94 80.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.588 1.155 . . . . 73.31 111.585 176.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 25.6 t -57.33 -55.75 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 124.06 0.944 . . . . 62.11 111.17 178.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.647 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.5 pt20 -68.82 -27.14 65.58 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 116.154 -0.476 . . . . 73.41 111.668 -177.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.431 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 13.0 t70 -70.53 -33.15 70.84 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 109.751 -0.462 . . . . 54.32 109.751 177.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.47 HD11 HG13 ' B' ' 130' ' ' VAL . 13.1 mt -74.88 -46.59 35.16 Favored 'General case' 0 C--N 1.353 0.722 0 CA-C-N 116.11 -0.495 . . . . 75.35 110.036 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.647 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.3 t -66.1 -23.82 66.58 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 123.188 0.305 . . . . 74.54 111.637 177.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.02 -48.79 69.95 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.265 0.626 . . . . 42.54 110.73 172.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.607 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.7 mt -75.4 -22.84 57.12 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.523 0.729 . . . . 63.34 111.931 177.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.1 tt -73.08 -59.07 2.88 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 124.418 1.087 . . . . 45.45 109.085 -179.782 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -65.99 -20.29 66.14 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.061 0.944 . . . . 61.13 112.268 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -133.06 80.84 1.91 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.766 0.827 . . . . 74.34 109.574 176.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 65.9 mttt -72.77 142.05 48.11 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 113.125 0.787 . . . . 71.41 113.125 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -118.93 43.31 2.59 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 125.6 1.56 . . . . 62.43 107.057 171.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 t70 . . . . . 0 CA--C 1.564 1.511 0 CA-C-N 114.173 -1.376 . . . . 73.44 112.21 -164.88 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 CA-C-O 120.075 -0.291 . . . . 64.41 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 57.1 m -143.93 174.85 10.48 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.39 0.676 . . . . 74.14 111.625 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.486 ' HB2' ' HE1' ' B' ' 73' ' ' HIS . 3.8 p-10 -99.73 128.97 45.81 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 124.34 1.056 . . . . 72.11 112.335 -173.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -142.93 -9.62 0.79 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 123.948 0.899 . . . . 75.11 113.388 -171.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 16.2 mm-40 -65.26 -179.41 0.59 Allowed 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 113.45 0.907 . . . . 72.3 113.45 -176.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -105.92 86.75 2.44 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.52 0.728 . . . . 64.42 109.125 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . 0.597 ' H ' ' HB2' ' B' ' 73' ' ' HIS . 8.1 p-10 -149.17 129.16 13.46 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-O 121.52 0.676 . . . . 63.54 112.195 -172.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.417 ' HB3' ' HA2' ' B' ' 72' ' ' GLY . 4.7 p-10 -80.46 -12.99 59.48 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.913 -0.492 . . . . 72.04 111.081 167.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -52.0 -40.26 60.69 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.668 1.187 . . . . 73.53 113.801 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 3.8 p -60.15 -25.11 65.26 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.653 0.983 . . . . 72.12 113.653 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.447 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 61.7 m95 -50.32 -18.86 0.68 Allowed 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.881 1.067 . . . . 73.23 113.881 171.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 45.2 t -49.78 -38.5 34.4 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 124.219 1.008 . . . . 63.52 112.959 174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . 0.44 HG11 HG22 ' B' ' 95' ' ' THR . 56.9 t -59.72 -39.31 79.36 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.564 0.746 . . . . 75.23 111.021 177.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 81.5 mt -78.09 -38.88 43.16 Favored 'General case' 0 CA--C 1.553 1.076 0 CA-C-N 115.474 -0.785 . . . . 75.22 111.678 176.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -48.71 -52.21 24.7 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 125.071 1.348 . . . . 75.44 112.725 -178.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.7 -16.48 30.61 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 115.529 0.971 . . . . 65.25 115.529 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.723 ' HB2' HG12 ' B' ' 94' ' ' VAL . 51.0 m-85 -132.42 18.51 4.38 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.489 0.716 . . . . 74.53 110.897 178.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -64.84 -25.65 68.0 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 122.489 -0.132 . . . . 61.41 111.147 -176.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.5 p -59.93 -38.39 76.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 123.545 0.738 . . . . 75.42 111.723 173.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 7.2 m -76.04 -46.69 27.98 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.934 0.494 . . . . 50.45 110.144 175.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 95.9 mt -56.13 -40.58 73.98 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.727 -0.669 . . . . 75.42 111.912 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.521 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -75.04 -35.89 61.9 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.264 -0.425 . . . . 74.33 111.733 179.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 46.5 t -75.08 -25.41 58.56 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.868 0.467 . . . . 62.53 112.039 -177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.555 HG11 HD21 ' B' ' 90' ' ' LEU . 76.5 t -96.13 -54.51 7.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 N-CA-C 112.987 0.736 . . . . 51.11 112.987 -178.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.3 mp -69.57 149.18 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 CA-C-O 121.379 0.609 . . . . 71.23 111.768 -170.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.8 m-20 -113.01 117.94 45.24 Favored Pre-proline 0 C--O 1.252 1.198 0 C-N-CA 123.313 0.645 . . . . 71.51 109.405 172.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 72.3 Cg_exo -50.68 -35.8 48.64 Favored 'Trans proline' 0 C--N 1.381 2.282 0 C-N-CA 122.703 2.269 . . . . 75.24 112.115 177.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.491 ' HB3' HD11 ' B' ' 49' ' ' LEU . 67.3 p -64.26 -26.97 68.73 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 124.213 1.005 . . . . 60.45 112.515 -173.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.408 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 9.7 ptp180 -90.59 -26.65 19.57 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.862 -0.524 . . . . 72.33 111.43 -178.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.4 pt -98.45 -16.57 7.03 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.475 0 N-CA-C 112.797 0.666 . . . . 71.22 112.797 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -55.54 -46.18 99.76 Favored Pre-proline 0 N--CA 1.502 2.167 0 N-CA-C 114.273 1.212 . . . . 74.42 114.273 -177.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.68 -31.17 40.81 Favored 'Trans proline' 0 C--N 1.395 2.997 0 CA-C-N 121.673 1.633 . . . . 72.33 112.969 178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -64.68 -50.36 67.3 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.37 0.668 . . . . 74.21 109.441 174.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.472 HD13 HD21 ' B' ' 68' ' ' LEU . 75.3 mt -63.08 -31.31 72.41 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.098 0.959 . . . . 71.5 112.386 179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -57.46 -52.99 63.14 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 123.437 0.695 . . . . 61.54 110.746 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -68.38 -26.76 65.73 Favored 'General case' 0 CA--C 1.556 1.21 0 C-N-CA 123.505 0.722 . . . . 70.3 112.174 -178.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 73.5 m -72.55 -8.65 56.29 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.072 0.549 . . . . 60.21 111.696 171.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 11.5 mmpt? 79.25 -1.77 2.24 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 125.898 1.679 . . . . 61.23 112.465 173.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.4 m -85.96 -35.94 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.962 0 C-N-CA 123.427 0.691 . . . . 74.21 112.362 -171.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.586 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.1 tt -94.19 127.47 40.04 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.79 0.836 . . . . 71.24 111.178 -178.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.6 m-80 -89.52 158.3 45.88 Favored Pre-proline 0 CA--C 1.561 1.386 0 C-N-CA 124.774 1.23 . . . . 70.21 111.325 177.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 15.3 Cg_endo -55.85 -26.38 57.23 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.075 2.517 . . . . 51.55 114.814 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -72.7 -36.9 67.94 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.907 0.483 . . . . 75.15 111.274 175.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.576 ' HA ' HE21 ' B' ' 47' ' ' GLN . 75.7 m-20 -63.72 -47.42 81.17 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 122.856 0.462 . . . . 54.02 112.031 -178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.586 ' HB3' HD21 ' B' ' 40' ' ' LEU . 6.5 pt-20 -65.36 -36.94 85.53 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 116.086 -0.506 . . . . 70.22 111.989 -178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -76.85 -33.27 57.91 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 119.371 -0.347 . . . . 73.52 111.46 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.576 HE21 ' HA ' ' B' ' 44' ' ' ASP . 29.3 pt20 -75.48 -32.7 60.66 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 118.408 0.549 . . . . 75.33 111.731 -179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.484 HG22 ' O ' ' B' ' 44' ' ' ASP . 24.9 m -79.28 -1.4 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 CA-C-N 118.099 0.409 . . . . 70.14 111.996 171.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' B' ' 28' ' ' SER . 4.2 mm? -115.77 11.69 15.71 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.979 0.912 . . . . 70.42 111.139 169.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 70.6 m -80.81 -4.1 53.44 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 122.88 0.472 . . . . 73.21 111.587 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.425 ' HB2' ' HZ2' ' B' ' 60' ' ' LYS . 4.8 m-20 -66.21 142.9 98.11 Favored Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 124.395 1.078 . . . . 71.51 110.852 175.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.41 2.44 6.28 Favored 'Trans proline' 0 CA--C 1.56 1.778 0 C-N-CA 122.835 2.357 . . . . 74.43 113.606 177.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.403 ' HB2' HG23 ' B' ' 55' ' ' VAL . 25.2 p30 -176.66 -176.92 0.76 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.204 1.002 . . . . 61.14 110.928 -171.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.449 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.4 pt? -104.32 1.5 30.39 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.52 0.728 . . . . 71.35 110.434 167.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.403 HG23 ' HB2' ' B' ' 53' ' ' ASN . 42.9 t -64.59 -31.55 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.605 0.762 . . . . 75.11 111.162 -179.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.428 HD12 ' HD3' ' B' ' 59' ' ' ARG . 19.7 pt -93.32 26.76 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.086 0.955 . . . . 64.42 112.529 176.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.537 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 46.3 mtt180 -37.43 -35.24 0.11 Allowed 'General case' 0 N--CA 1.508 2.432 0 C-N-CA 125.298 1.439 . . . . 63.2 114.16 173.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.1 tppp? -55.64 -51.55 66.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 124.222 1.009 . . . . 72.25 112.123 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.428 ' HD3' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -86.02 -29.3 23.57 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.633 0.373 . . . . 50.24 111.832 175.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.569 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 57.4 tttp -58.4 -49.09 78.5 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 124.488 1.115 . . . . 73.44 112.446 -178.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 10.9 t -84.82 -28.78 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.052 0 C-N-CA 123.107 0.563 . . . . 64.31 110.13 174.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.97 -43.16 87.88 Favored Glycine 0 C--N 1.356 1.675 0 O-C-N 123.226 0.328 . . . . 73.31 113.216 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.439 HG23 HG12 ' B' ' 48' ' ' VAL . 35.0 m -71.66 -31.37 41.77 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 123.007 0.523 . . . . 74.11 111.237 175.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.478 ' HB2' HG11 ' B' ' 48' ' ' VAL . 45.2 tp -67.75 -34.94 77.82 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.483 0.549 . . . . 71.32 112.483 176.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.447 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.8 mt -62.8 -50.83 69.46 Favored 'General case' 0 CA--C 1.555 1.16 0 CA-C-O 121.297 0.57 . . . . 54.2 109.487 173.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -54.67 -37.59 65.92 Favored 'General case' 0 CA--C 1.561 1.402 0 CA-C-N 114.364 -1.289 . . . . 72.41 111.503 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' B' ' 64' ' ' LEU . 31.2 mt -61.36 -59.55 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 124.346 1.058 . . . . 64.02 110.762 174.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.472 HD21 HD13 ' B' ' 34' ' ' LEU . 90.1 mt -62.82 -23.82 67.46 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.54 0.736 . . . . 60.31 112.668 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 56.7 mt-30 -64.35 -19.31 65.38 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 113.589 0.959 . . . . 73.42 113.589 171.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.36 -27.01 65.55 Favored 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 118.664 0.665 . . . . 74.51 111.874 173.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 73.5 p -103.14 14.37 31.94 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.699 0.8 . . . . 74.33 110.891 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . 0.417 ' HA2' ' HB3' ' B' ' 8' ' ' ASP . . . 53.96 -113.05 2.9 Favored Glycine 0 C--N 1.353 1.503 0 N-CA-C 115.321 0.889 . . . . 31.24 115.321 -177.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.597 ' HB2' ' H ' ' B' ' 7' ' ' ASP . 30.0 t60 -76.39 -25.61 54.74 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.8 1.24 . . . . 73.1 111.592 -175.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -62.44 -51.32 67.99 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 111.915 0.339 . . . . 60.23 111.915 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.83 -34.05 87.43 Favored Glycine 0 CA--C 1.532 1.148 0 O-C-N 123.57 0.544 . . . . 75.03 113.201 176.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.56 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 54.7 t80 -56.33 -62.94 1.37 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.951 0.9 . . . . 73.04 110.862 171.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.63 -44.16 75.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 C-N-CA 124.067 0.947 . . . . 54.22 111.251 -179.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.78 -45.6 89.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.756 0.822 . . . . 73.2 111.85 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -61.12 -43.39 98.96 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 122.979 0.512 . . . . 74.22 111.022 176.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 28.9 mt -65.82 -44.66 84.94 Favored 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 112.896 0.702 . . . . 64.53 112.896 -179.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.13 -33.28 73.21 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.525 0.73 . . . . 75.12 111.566 178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 73.4 m -63.08 -45.31 92.73 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-N 116.301 -0.409 . . . . 61.32 110.196 166.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.5 tp -64.9 -42.78 94.46 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.603 0.761 . . . . 62.3 111.615 -172.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 29.2 mm-40 -59.74 -24.62 64.17 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 112.876 0.695 . . . . 71.33 112.876 176.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -81.82 -57.57 3.37 Favored 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.646 0.778 . . . . 71.22 109.58 173.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -83.58 -56.78 3.54 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 113.61 0.967 . . . . 73.25 113.61 -170.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.697 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.6 m-85 -133.67 70.97 75.57 Favored Pre-proline 0 N--CA 1.504 2.231 0 CA-C-N 118.702 0.683 . . . . 64.1 111.739 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -64.08 -30.16 65.75 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.514 2.142 . . . . 74.21 114.451 -172.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.495 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.3 pt20 -63.67 -30.81 71.87 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 122.993 0.517 . . . . 71.13 111.89 177.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.697 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -64.16 -33.2 75.25 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.645 0.778 . . . . 52.22 111.258 174.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.465 ' CZ ' HG21 ' B' ' 95' ' ' THR . 68.1 t80 -72.19 -45.85 58.7 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-O 120.822 0.344 . . . . 74.4 110.423 172.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -59.96 -32.1 70.5 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 116.106 -0.497 . . . . 72.55 112.16 -178.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 19.0 ptmt -80.23 -37.23 33.45 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 112.452 0.538 . . . . 65.4 112.452 178.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.723 HG12 ' HB2' ' B' ' 17' ' ' PHE . 31.0 m -66.87 -44.5 88.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 CA-C-N 118.759 0.709 . . . . 54.4 112.307 177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.642 HG23 HG23 ' B' ' 94' ' ' VAL . 77.7 p -91.23 -43.43 9.83 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 113.223 0.823 . . . . 55.34 113.223 -175.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -13.74 64.36 Favored Glycine 0 N--CA 1.477 1.375 0 CA-C-N 116.363 -0.38 . . . . 15.41 113.151 -172.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -140.26 175.11 9.86 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.682 0.793 . . . . 73.23 111.572 -176.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.47 153.82 89.88 Favored Pre-proline 0 CA--C 1.565 1.525 0 C-N-CA 123.593 0.757 . . . . 72.23 110.996 175.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.689 ' HG2' ' HG3' ' B' ' 101' ' ' ARG . 95.8 Cg_endo -79.76 179.59 6.16 Favored 'Trans proline' 0 C--N 1.373 1.864 0 C-N-CA 122.672 2.248 . . . . 64.31 112.759 174.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.62 -19.3 55.75 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.307 -0.86 . . . . 42.12 110.295 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.689 ' HG3' ' HG2' ' B' ' 99' ' ' PRO . 73.7 mtt180 59.32 59.6 2.62 Favored 'General case' 0 C--N 1.361 1.107 0 C-N-CA 124.1 0.96 . . . . 72.11 112.456 -178.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 10.5 t -77.3 51.14 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.664 0 CA-C-N 113.792 -1.549 . . . . 70.14 110.701 179.292 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.427 ' O ' HG12 ' B' ' 107' ' ' ILE . 85.7 m-85 -52.49 -21.33 3.64 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.356 -0.84 . . . . 71.32 112.085 168.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.638 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.4 p -63.07 -17.93 62.81 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.525 0.73 . . . . 75.01 111.379 175.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 7.9 tpt -53.56 -63.54 1.12 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.006 0.923 . . . . 74.23 110.989 169.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.505 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -71.49 -32.11 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.141 0.576 . . . . 62.44 110.783 -179.974 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.638 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 43.6 mm -59.98 -42.4 89.43 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.626 0 C-N-CA 123.045 0.538 . . . . 65.34 111.919 175.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -82.67 -30.06 29.53 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.607 -0.683 . . . . 64.34 112.824 174.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -68.03 -57.74 5.65 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.103 0.561 . . . . 65.31 112.343 -176.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 41.7 t -104.09 -39.92 6.37 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 123.421 0.688 . . . . 72.41 111.228 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.11 163.09 9.38 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.925 -0.58 . . . . 30.43 112.766 -176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -58.15 -47.6 82.84 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.527 0.731 . . . . 51.55 110.835 172.605 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.442 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 84.0 p -64.67 -20.94 66.59 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 115.411 -0.813 . . . . 54.41 111.992 175.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.42 -56.85 17.44 Favored Glycine 0 C--N 1.353 1.477 0 CA-C-N 117.44 0.109 . . . . 73.1 112.847 172.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.505 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.3 tp -67.63 -32.36 73.01 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 122.809 0.443 . . . . 74.52 111.596 175.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.442 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 72.7 m -57.46 -46.69 83.36 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.203 0.601 . . . . 73.05 110.2 172.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -67.68 -39.14 84.47 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.071 0.548 . . . . 72.04 112.313 176.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 80.2 mt -55.66 -52.08 65.05 Favored 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 121.208 0.528 . . . . 60.3 111.367 175.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.551 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 46.8 mt -69.19 -46.71 66.79 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-N 115.502 -0.772 . . . . 74.35 111.756 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.512 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.6 tpt -53.56 -45.1 69.79 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.477 1.111 . . . . 74.41 112.933 176.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.0 t -72.97 -35.63 66.95 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.616 -0.677 . . . . 70.51 111.499 174.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -62.28 -35.44 79.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.959 0.504 . . . . 73.43 111.894 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.512 HG22 ' O ' ' B' ' 120' ' ' MET . 8.9 m -67.03 -22.72 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 CA-C-O 119.394 -0.336 . . . . 73.42 111.259 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 52.1 mtm -77.88 -37.55 47.89 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 122.537 0.335 . . . . 65.32 110.187 177.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.7 mmpt? -63.46 -46.28 86.99 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.364 0.666 . . . . 73.04 110.915 173.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.6 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 36.1 mt -61.97 -42.64 99.35 Favored 'General case' 0 C--O 1.212 -0.896 0 C-N-CA 124.319 1.048 . . . . 53.42 112.115 173.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -65.58 -37.82 87.75 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.312 0.645 . . . . 62.14 111.139 179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 27.3 tptp -65.97 -44.8 83.89 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.466 1.106 . . . . 74.31 109.681 176.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.478 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 23.1 tptm -64.5 -40.2 95.21 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.831 -1.077 . . . . 42.42 111.588 177.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.48 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -64.52 -48.88 83.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.486 0.714 . . . . 72.34 110.913 177.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.533 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.7 pt20 -66.79 -28.24 68.23 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.133 0.173 . . . . 70.51 110.851 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.508 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 21.4 t70 -64.49 -56.8 11.74 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 122.794 0.437 . . . . 72.22 110.228 171.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.513 HD13 ' HB ' ' A' ' 134' ' ' THR . 15.0 mt -68.67 -25.29 64.73 Favored 'General case' 0 N--CA 1.484 1.227 0 N-CA-C 112.514 0.561 . . . . 71.32 112.514 -173.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.533 HG22 ' HA ' ' B' ' 131' ' ' GLN . 4.2 t -80.97 -31.53 34.8 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 122.608 0.363 . . . . 62.33 110.353 174.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.11 -35.2 79.86 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.96 0.504 . . . . 74.32 111.354 170.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 46.6 mt -78.8 -32.54 46.39 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.521 0.728 . . . . 71.32 110.7 176.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 mt -64.45 -31.68 72.99 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.045 0.538 . . . . 72.41 110.933 168.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.8 t -78.21 -36.21 47.53 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.959 0.504 . . . . 74.12 111.63 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.0 m -149.16 99.05 2.9 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.075 0.95 . . . . 70.11 110.052 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -86.96 155.09 20.33 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.097 0.959 . . . . 71.24 111.944 -173.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.0 72.95 2.22 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 108.67 -0.863 . . . . 51.42 108.67 176.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 11.0 t70 . . . . . 0 CA--C 1.564 1.481 0 CA-C-N 115.433 -0.803 . . . . 72.2 110.846 -177.031 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.934 0 CA-C-O 120.4 -0.111 . . . . 74.14 113.207 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.6 t -73.72 96.84 2.58 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.124 0.57 . . . . 73.52 111.024 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -82.81 121.61 27.14 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.257 0.551 . . . . 72.41 111.761 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 86.3 m-85 -107.95 -31.3 8.04 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.398 1.079 . . . . 63.31 109.578 171.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -78.82 -13.14 59.97 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.358 1.063 . . . . 54.42 113.286 -172.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.9 p-10 -76.28 125.52 29.33 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 109.877 -0.416 . . . . 72.04 109.877 174.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -74.03 92.38 2.14 Favored 'General case' 0 CA--C 1.554 1.125 0 CA-C-O 121.671 0.748 . . . . 73.33 111.51 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -81.95 -16.5 50.25 Favored 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 124.606 1.163 . . . . 74.54 112.379 179.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -53.49 -60.37 3.39 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.981 0.912 . . . . 64.43 112.425 -174.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 14.9 p -68.04 -30.27 69.45 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.777 0.431 . . . . 71.05 111.978 -179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.8 m95 -56.9 -21.1 27.11 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 114.059 1.133 . . . . 75.1 114.059 175.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 94.7 p -60.46 -26.47 66.79 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 118.614 0.643 . . . . 63.21 112.267 175.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.1 t -70.92 -50.64 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 C-N-CA 124.397 1.079 . . . . 74.31 111.225 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 62.5 mt -66.0 -36.25 82.79 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 122.617 0.367 . . . . 72.25 111.558 173.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -49.95 -53.95 23.02 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.714 1.205 . . . . 72.43 112.13 176.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.41 -9.83 13.99 Favored Glycine 0 CA--C 1.544 1.9 0 N-CA-C 115.453 0.941 . . . . 74.12 115.453 178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -120.42 2.1 10.74 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 118.209 1.004 . . . . 71.22 112.524 177.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -64.59 -25.42 67.96 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 113.061 0.763 . . . . 61.45 113.061 -172.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.5 p -57.37 -31.83 39.48 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 C-N-CA 123.645 0.778 . . . . 64.01 111.554 172.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.0 m -90.88 -40.47 11.72 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.931 0.892 . . . . 51.5 110.858 176.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.55 HD23 HD12 ' A' ' 90' ' ' LEU . 83.3 mt -60.37 -38.55 84.23 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.194 0.598 . . . . 63.34 112.53 -177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 56.4 p -70.59 -34.12 71.82 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 113.327 0.862 . . . . 74.21 113.327 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 58.4 p -86.87 -35.96 18.71 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.447 0.699 . . . . 71.13 112.775 -175.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.721 HG11 HD21 ' A' ' 90' ' ' LEU . 47.4 t -87.21 -42.16 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 112.962 0.727 . . . . 73.13 112.962 -177.675 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.564 HD13 HD11 ' A' ' 83' ' ' LEU . 48.4 mt -86.85 151.68 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.268 0.47 . . . . 73.41 112.268 -174.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -113.23 117.99 44.7 Favored Pre-proline 0 C--O 1.251 1.152 0 C-N-CA 124.006 0.923 . . . . 72.35 110.249 176.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.645 ' HG2' ' HB3' ' A' ' 60' ' ' LYS . 26.9 Cg_exo -58.07 -24.19 64.71 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.892 2.395 . . . . 65.41 112.664 -177.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 16.5 m -74.22 -32.59 63.07 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.117 0.967 . . . . 62.52 111.03 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' ' CE1' ' A' ' 87' ' ' TYR . 10.1 ptp180 -85.08 -28.13 25.83 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-O 120.79 0.329 . . . . 75.22 110.691 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.6 pt -91.89 -10.26 9.84 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.875 0.47 . . . . 72.12 111.485 -178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.548 ' HA ' HD13 ' A' ' 40' ' ' LEU . 20.7 m -51.01 -55.18 30.04 Favored Pre-proline 0 CA--C 1.567 1.618 0 CA-C-O 118.12 -0.943 . . . . 51.3 112.779 174.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -61.41 -35.56 82.62 Favored 'Trans proline' 0 C--N 1.399 3.186 0 C-N-CA 121.942 1.761 . . . . 64.4 113.346 -177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.4 t80 -65.15 -52.26 56.23 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.52 0.328 . . . . 71.14 110.713 175.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.22 -24.75 68.02 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.532 0.733 . . . . 74.13 112.492 -179.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.424 HH12 ' HB3' ' A' ' 42' ' ' PRO . 9.6 mmm180 -61.91 -53.84 50.21 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.712 0.805 . . . . 64.22 110.466 170.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' HD11 ' A' ' 106' ' ' ILE . 11.8 mm100 -65.15 -23.57 67.15 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.861 0.864 . . . . 72.24 111.946 178.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 81.1 m -79.36 -9.63 59.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.203 0.601 . . . . 74.01 112.076 173.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 72.77 14.79 4.91 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.967 1.307 . . . . 73.31 112.288 173.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -102.51 -31.57 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.748 0.819 . . . . 63.51 111.796 -175.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.783 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.2 tt -98.04 128.32 44.51 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.708 0.803 . . . . 75.12 109.535 177.265 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.8 m-80 -102.35 160.77 25.35 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.688 1.195 . . . . 72.34 111.208 -175.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.424 ' HB3' HH12 ' A' ' 35' ' ' ARG . 32.9 Cg_endo -61.2 -23.12 76.54 Favored 'Trans proline' 0 C--N 1.38 2.199 0 C-N-CA 122.472 2.115 . . . . 54.23 114.861 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -84.55 -41.63 16.28 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 113.243 0.831 . . . . 73.22 113.243 -178.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.623 ' HB2' HD13 ' A' ' 67' ' ' ILE . 3.4 p30 -73.18 -40.51 64.73 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 112.715 0.635 . . . . 74.43 112.715 -174.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.783 ' HB3' HD21 ' A' ' 40' ' ' LEU . 11.3 pt-20 -51.21 -33.39 27.48 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 112.362 0.504 . . . . 71.35 112.362 165.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -73.44 -43.66 59.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.66 0.384 . . . . 70.5 111.675 176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.502 ' HG3' ' O ' ' A' ' 44' ' ' ASP . 0.9 OUTLIER -64.17 -36.31 83.64 Favored 'General case' 0 N--CA 1.5 2.061 0 CA-C-N 118.156 0.435 . . . . 74.1 111.11 178.309 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 87.3 t -65.91 -49.85 74.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 123.124 0.57 . . . . 74.12 110.418 173.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -86.01 30.85 0.65 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.596 0.758 . . . . 71.54 112.458 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.7 p -61.08 -36.07 78.65 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-O 121.362 0.601 . . . . 53.0 110.398 170.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.3 t0 -95.54 125.38 49.73 Favored Pre-proline 0 CA--C 1.554 1.102 0 C-N-CA 124.504 1.122 . . . . 73.24 108.984 166.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -67.64 -32.63 30.25 Favored 'Trans proline' 0 CA--C 1.558 1.705 0 C-N-CA 122.29 1.993 . . . . 74.43 112.247 173.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.4 ' O ' ' HE3' ' A' ' 60' ' ' LYS . 21.5 m-80 -79.42 176.45 9.68 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 124.015 0.926 . . . . 71.45 112.052 -178.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -98.37 28.49 4.09 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.039 0.535 . . . . 73.21 112.112 173.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.7 t -66.28 -47.22 85.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.892 -0.505 . . . . 63.23 111.182 -178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 43.7 pt -98.88 25.36 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 C-N-CA 123.42 0.688 . . . . 71.23 112.168 176.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -48.22 -33.91 9.35 Favored 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 124.957 1.303 . . . . 71.4 113.481 -179.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? -61.82 -54.09 47.0 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 65.41 111.438 -179.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.0 ptp180 -76.61 -20.47 56.71 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 111.994 0.368 . . . . 74.31 111.994 176.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.645 ' HB3' ' HG2' ' A' ' 27' ' ' PRO . 36.6 mttm -60.32 -51.81 67.94 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.273 0.629 . . . . 55.22 111.771 175.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 16.8 t -70.92 -37.83 69.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 109.794 -0.447 . . . . 52.03 109.794 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.83 -41.79 96.24 Favored Glycine 0 C--N 1.352 1.441 0 O-C-N 123.672 0.607 . . . . 34.04 114.04 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.1 m -76.11 -32.67 23.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 122.696 0.398 . . . . 73.12 111.127 176.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.607 ' HA ' HD12 ' A' ' 67' ' ' ILE . 46.1 tp -60.49 -35.37 75.77 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.831 0.452 . . . . 75.04 111.714 175.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.7 mt -57.72 -44.06 85.68 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.029 0.532 . . . . 74.53 111.175 173.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 17.8 m-20 -66.45 -36.8 83.68 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.9 0.88 . . . . 72.51 112.43 175.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.623 HD13 ' HB2' ' A' ' 44' ' ' ASP . 95.6 mt -61.29 -42.2 92.62 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 124.194 0.998 . . . . 74.32 111.244 175.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 59.3 mt -84.07 -21.36 31.55 Favored 'General case' 0 CA--C 1.567 1.63 0 C-N-CA 123.187 0.595 . . . . 74.43 111.307 178.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -66.33 -37.23 84.86 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.505 1.122 . . . . 74.21 112.486 177.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 14.1 ptm180 -66.81 -25.31 66.39 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 122.665 0.386 . . . . 71.25 111.56 -179.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 50.0 p -87.14 -9.2 55.89 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.105 0.562 . . . . 34.32 111.358 176.76 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.34 -127.51 20.82 Favored Glycine 0 C--N 1.352 1.431 0 N-CA-C 115.016 0.766 . . . . 74.52 115.016 179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.0 t60 -62.63 -25.0 67.89 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.792 0.837 . . . . 75.22 110.777 -177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.481 ' HA ' ' HE1' ' A' ' 105' ' ' MET . 10.8 mmmm -54.19 -62.99 1.3 Allowed 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 114.95 -1.023 . . . . 73.31 111.444 171.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.19 -36.71 93.19 Favored Glycine 0 CA--C 1.529 0.953 0 CA-C-N 116.479 -0.328 . . . . 61.24 113.116 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.8 t80 -51.57 -66.36 0.4 Allowed 'General case' 0 CA--C 1.562 1.406 0 C-N-CA 123.829 0.851 . . . . 63.03 112.829 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.432 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -63.79 -34.47 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 C-N-CA 122.873 0.469 . . . . 52.11 112.192 -178.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.28 -46.67 87.91 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.798 0.439 . . . . 75.13 111.913 174.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.454 ' O ' HD13 ' A' ' 83' ' ' LEU . 56.8 t80 -66.32 -43.54 85.88 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.471 0.708 . . . . 72.43 110.239 179.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.543 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.4 mt -50.99 -57.72 7.87 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.672 0.789 . . . . 61.01 112.483 173.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -73.01 -22.85 60.6 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 112.54 0.57 . . . . 72.11 112.54 -175.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.4 t -62.07 -51.81 66.47 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 120.769 0.318 . . . . 71.42 110.154 167.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.564 HD11 HD13 ' A' ' 25' ' ' ILE . 8.3 mp -59.02 -42.44 90.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.587 0.755 . . . . 75.23 111.8 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -46.97 -37.72 9.53 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 124.172 0.989 . . . . 74.2 112.083 177.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.9 tt -85.23 -53.09 5.46 Favored 'General case' 0 CA--C 1.568 1.65 0 C-N-CA 123.936 0.894 . . . . 73.32 110.712 177.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -81.34 -59.85 2.48 Favored 'General case' 0 N--CA 1.495 1.809 0 N-CA-C 113.212 0.819 . . . . 74.13 113.212 -171.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.69 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.7 m-85 -119.76 79.09 23.17 Favored Pre-proline 0 N--CA 1.491 1.576 0 C-N-CA 123.36 0.664 . . . . 71.13 110.97 179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -59.46 -34.82 97.17 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.605 2.203 . . . . 73.31 113.528 -174.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.526 ' HG3' HD22 ' A' ' 90' ' ' LEU . 18.3 pt20 -64.26 -37.73 88.54 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 123.004 0.522 . . . . 71.11 112.081 176.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.721 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.12 -41.77 94.57 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 122.95 0.5 . . . . 71.42 110.905 175.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.543 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 62.5 t80 -62.49 -48.75 78.22 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-O 120.887 0.375 . . . . 73.1 111.319 173.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.576 ' HE3' ' HA ' ' A' ' 98' ' ' GLU . 11.5 mmmm -52.91 -40.9 63.94 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.571 1.149 . . . . 71.32 113.895 176.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.41 ' HB3' ' HE2' ' A' ' 93' ' ' LYS . 16.1 ptpt -78.17 -42.44 31.6 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 112.337 0.495 . . . . 75.32 112.337 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 27.5 m -62.69 -38.25 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 CA-C-N 118.422 0.555 . . . . 74.02 112.022 179.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.45 -34.59 28.09 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.442 0.297 . . . . 62.14 111.446 174.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 86.56 -13.8 57.23 Favored Glycine 0 N--CA 1.477 1.428 0 N-CA-C 114.674 0.63 . . . . 42.33 114.674 177.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.486 ' H ' ' HD2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -118.92 -175.9 3.0 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-N 117.601 0.7 . . . . 71.11 110.686 -179.795 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.576 ' HA ' ' HE3' ' A' ' 92' ' ' LYS . 13.2 pt-20 -57.59 156.0 18.65 Favored Pre-proline 0 CA--C 1.571 1.761 0 C-N-CA 123.17 0.588 . . . . 74.21 111.38 171.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.488 ' HD3' ' HD3' ' A' ' 92' ' ' LYS . 43.2 Cg_endo -62.06 118.79 5.68 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.334 2.023 . . . . 62.32 113.342 -172.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.02 84.31 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 122.973 0.509 . . . . 62.45 110.472 -179.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.3 tpp85 68.93 53.31 0.49 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.357 1.075 . . . . 71.13 109.84 172.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 8.2 t -82.24 45.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.709 0 C-N-CA 124.757 1.223 . . . . 74.43 111.571 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.571 ' HD1' HD21 ' A' ' 115' ' ' LEU . 3.4 m-30 -63.96 -8.48 11.54 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.587 0.755 . . . . 74.41 112.552 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 m -60.77 -23.5 65.05 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.515 0.726 . . . . 62.55 110.956 171.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.481 ' HE1' ' HA ' ' A' ' 74' ' ' LYS . 13.9 tpt -54.49 -63.29 1.2 Allowed 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.923 1.289 . . . . 63.44 111.582 170.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.566 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -71.4 -26.85 27.31 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.609 0 C-N-CA 123.47 0.708 . . . . 63.32 110.783 -177.354 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.417 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.8 mm -62.67 -40.71 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 122.887 0.475 . . . . 74.15 111.292 169.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -76.86 -27.69 55.16 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.831 -0.543 . . . . 70.11 111.514 175.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -71.83 -62.56 1.38 Allowed 'General case' 0 CA--C 1.563 1.46 0 N-CA-C 113.546 0.943 . . . . 75.42 113.546 -178.172 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 54.8 m -114.34 8.47 16.68 Favored 'General case' 0 N--CA 1.505 2.298 0 N-CA-C 112.619 0.6 . . . . 33.21 112.619 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.71 168.24 43.85 Favored Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.871 -0.204 . . . . 70.43 112.6 -176.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -59.88 -39.33 84.93 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.735 0.414 . . . . 75.44 110.79 171.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 56.2 p -57.8 -38.25 75.2 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.346 1.058 . . . . 73.22 111.773 173.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.4 -55.76 28.93 Favored Glycine 0 C--N 1.354 1.534 0 O-C-N 123.175 0.297 . . . . 62.22 113.41 177.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.571 HD21 ' HD1' ' A' ' 103' ' ' PHE . 27.4 tp -64.26 -38.04 89.63 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.677 0.391 . . . . 73.44 111.763 176.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 96.1 m -57.43 -45.65 84.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.184 0.594 . . . . 73.24 111.151 176.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 28.6 mm-40 -69.14 -40.95 77.94 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.179 0.592 . . . . 74.11 111.848 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.481 ' HB2' ' HG3' ' A' ' 36' ' ' GLN . 3.2 tm? -57.6 -46.54 83.93 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.258 0.623 . . . . 61.11 110.825 176.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 91.8 mt -69.79 -41.2 75.38 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 123.479 0.711 . . . . 61.44 111.218 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.69 ' SD ' ' HD3' ' B' ' 101' ' ' ARG . 0.0 OUTLIER -60.53 -37.45 81.2 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.636 0.774 . . . . 72.11 111.36 -179.594 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.8 t -78.09 -40.59 37.96 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.272 0.471 . . . . 70.43 112.272 171.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -62.6 -33.21 74.54 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.209 0.603 . . . . 72.15 112.54 -177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.6 m -66.68 -28.12 42.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 O-C-N 122.191 -0.318 . . . . 74.53 111.213 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.481 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 72.5 mtm -80.77 -35.09 33.66 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.774 0.43 . . . . 64.33 109.975 177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE3' ' A' ' 125' ' ' LYS . 26.8 mtpp -62.3 -41.49 98.55 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.806 0.843 . . . . 73.22 110.807 172.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 14.3 mt -67.47 -39.53 85.28 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 115.277 -0.874 . . . . 73.25 110.399 174.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.5 tp-100 -65.04 -27.98 69.17 Favored 'General case' 0 CA--C 1.561 1.377 0 C-N-CA 122.822 0.449 . . . . 73.23 111.302 174.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.2 mmtt -71.07 -42.73 69.01 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 109.647 -0.501 . . . . 44.41 109.647 171.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.0 tptt -65.64 -30.26 70.94 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.654 0.782 . . . . 73.31 112.081 177.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 126' ' ' LEU . 45.6 t -67.27 -54.98 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 C-N-CA 123.318 0.647 . . . . 62.11 110.245 176.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.73 ' HA ' HG22 ' A' ' 134' ' ' THR . 13.3 pt20 -66.72 -27.6 67.76 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 116.68 -0.236 . . . . 73.41 111.632 179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 33.8 t70 -56.36 -41.47 76.22 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.496 1.118 . . . . 54.32 111.219 173.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 12.0 mt -85.61 -44.36 12.69 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-N 115.941 -0.572 . . . . 75.35 111.538 -176.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.73 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.0 t -68.02 -26.39 65.87 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 112.226 0.454 . . . . 74.54 112.226 -178.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.83 -40.26 87.92 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.883 0.473 . . . . 42.54 111.373 174.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.494 ' HB2' HD11 ' B' ' 137' ' ' LEU . 70.3 mt -69.27 -51.33 38.57 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.985 0.514 . . . . 63.34 110.458 175.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.523 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.8 tt -44.43 -48.46 9.93 Favored 'General case' 0 N--CA 1.495 1.805 0 C-N-CA 125.715 1.606 . . . . 45.45 111.236 173.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.3 t -68.58 -37.97 80.31 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.323 -0.853 . . . . 61.13 112.259 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 40.9 m -118.97 45.64 2.04 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.33 0.652 . . . . 74.34 112.269 -175.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.428 ' HD2' HD23 ' B' ' 137' ' ' LEU . 43.3 mtpt -70.65 -176.97 1.41 Allowed 'General case' 0 N--CA 1.495 1.78 0 CA-C-O 121.637 0.732 . . . . 71.41 112.198 175.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -73.28 -17.76 61.29 Favored 'General case' 0 CA--C 1.559 1.298 0 CA-C-N 115.553 -0.749 . . . . 62.43 112.442 176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 . . . . . 0 CA--C 1.575 1.926 0 CA-C-O 118.57 -0.728 . . . . 73.44 111.598 175.521 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.036 0 CA-C-O 120.053 -0.304 . . . . 64.41 112.645 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 24.7 t -103.75 18.15 22.56 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.468 0.707 . . . . 74.14 110.82 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -68.98 166.89 17.0 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.885 1.274 . . . . 72.11 112.138 -177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -104.88 -36.71 7.27 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.381 0.672 . . . . 75.11 111.791 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -80.55 15.06 1.79 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 114.18 1.178 . . . . 72.3 114.18 -170.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -71.08 117.93 13.2 Favored 'General case' 0 N--CA 1.488 1.431 0 CA-C-O 121.506 0.67 . . . . 64.42 110.769 172.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . 0.611 ' H ' ' HA2' ' B' ' 72' ' ' GLY . 29.4 t70 -94.35 82.42 4.07 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 124.046 0.938 . . . . 63.54 111.221 -170.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -83.83 -22.7 31.66 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.072 -0.967 . . . . 72.04 113.236 -177.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.03 -36.92 83.01 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 113.404 0.89 . . . . 73.53 113.404 -165.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 18.3 p -75.75 -26.5 57.49 Favored 'General case' 0 N--CA 1.488 1.43 0 N-CA-C 112.992 0.738 . . . . 72.12 112.992 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -54.46 -17.34 3.03 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 113.665 0.987 . . . . 73.23 113.665 173.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 80.5 p -54.25 -33.9 59.52 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.743 0.817 . . . . 63.52 112.673 172.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 59.3 t -66.33 -38.78 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 124.04 0.936 . . . . 75.23 111.638 177.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.428 HD23 ' HB ' ' B' ' 94' ' ' VAL . 95.7 mt -78.4 -31.33 48.24 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.591 0.356 . . . . 75.22 111.369 174.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.4 ' O ' ' HG2' ' B' ' 18' ' ' ARG . 9.4 tp10 -50.49 -53.39 30.26 Favored 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 125.241 1.416 . . . . 75.44 113.375 -176.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.58 -15.34 32.44 Favored Glycine 0 CA--C 1.541 1.666 0 N-CA-C 114.635 0.614 . . . . 65.25 114.635 179.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -120.45 1.21 10.66 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.537 0.735 . . . . 74.53 111.857 178.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.4 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 33.3 ptt85 -67.06 -26.33 66.69 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 118.641 0.655 . . . . 61.41 111.998 -173.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 3.2 p -58.29 -41.94 82.47 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 C-N-CA 123.58 0.752 . . . . 75.42 111.258 170.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 28.3 m -73.61 -39.85 64.26 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.621 0.768 . . . . 50.45 110.442 175.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.575 ' HA ' HD13 ' B' ' 25' ' ' ILE . 93.2 mt -64.13 -40.12 95.51 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.315 0.646 . . . . 75.42 112.393 -177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.549 HG22 ' HB ' ' B' ' 61' ' ' VAL . 30.7 p -71.15 -30.55 66.6 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 113.063 0.764 . . . . 74.33 113.063 179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 78.6 p -82.51 -37.31 25.43 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 112.376 0.509 . . . . 62.53 112.376 178.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.638 HG11 HD21 ' B' ' 90' ' ' LEU . 86.5 t -88.55 -46.41 15.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 N-CA-C 113.014 0.746 . . . . 51.11 113.014 -175.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.575 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.4 mp -79.58 130.41 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 CA-C-O 121.035 0.445 . . . . 71.23 111.555 -175.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 2.6 m-20 -93.31 105.04 13.95 Favored Pre-proline 0 C--O 1.248 1.002 0 C-N-CA 123.793 0.837 . . . . 71.51 109.713 175.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.663 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.3 Cg_endo -72.2 -12.54 27.88 Favored 'Trans proline' 0 C--N 1.367 1.53 0 C-N-CA 122.262 1.975 . . . . 75.24 110.624 -175.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -74.86 -25.81 59.23 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.095 1.358 . . . . 60.45 111.935 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.2 ptp180 -94.45 -29.56 14.89 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 112.527 0.566 . . . . 72.33 112.527 -176.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.4 pt -90.31 -0.82 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 N-CA-C 113.054 0.761 . . . . 71.22 113.054 -172.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.433 HG23 ' O ' ' B' ' 27' ' ' PRO . 63.2 p -54.72 -42.71 96.53 Favored Pre-proline 0 CA--C 1.572 1.822 0 N-CA-C 114.11 1.152 . . . . 74.42 114.11 178.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.414 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 23.6 Cg_exo -66.04 -35.72 32.92 Favored 'Trans proline' 0 C--N 1.403 3.418 0 C-N-CA 121.914 1.742 . . . . 72.33 113.676 176.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 23.6 t80 -64.08 -44.18 93.14 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 109.82 -0.437 . . . . 74.21 109.82 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 91.4 mt -68.06 -25.95 65.61 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 112.716 0.636 . . . . 71.5 112.716 178.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 24.8 mmm-85 -65.29 -48.51 72.9 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 123.217 0.607 . . . . 61.54 110.478 168.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.546 ' HG3' HD23 ' B' ' 118' ' ' LEU . 13.9 mm100 -61.81 -31.32 71.53 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 123.949 0.9 . . . . 70.3 111.687 174.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 93.3 m -78.57 -10.48 59.75 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.115 0.566 . . . . 60.21 111.556 173.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm 71.24 13.17 6.74 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.717 1.207 . . . . 61.23 113.037 171.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 34.8 m -96.42 -34.07 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 C-N-CA 123.489 0.716 . . . . 74.21 111.499 -177.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.3 tt -92.79 131.78 37.55 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.763 0.825 . . . . 71.24 109.76 178.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -96.4 158.79 33.25 Favored Pre-proline 0 N--CA 1.483 1.22 0 C-N-CA 123.891 0.876 . . . . 70.21 111.427 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -53.65 -21.75 20.44 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.274 2.649 . . . . 51.55 114.744 176.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -75.01 -42.38 57.51 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.704 0.802 . . . . 75.15 111.432 174.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.624 ' HB3' HD13 ' B' ' 67' ' ' ILE . 71.8 m-20 -65.1 -41.2 95.19 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.144 0.978 . . . . 54.02 112.452 -174.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.543 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.1 pt-20 -66.12 -33.09 74.99 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 115.671 -0.695 . . . . 70.22 111.142 176.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -67.11 -50.54 61.15 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 122.303 0.241 . . . . 73.52 110.609 175.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.401 ' NE2' HD11 ' B' ' 67' ' ' ILE . 1.2 pp0? -70.35 -27.34 64.26 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.254 0.835 . . . . 75.33 113.254 -176.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 78.1 t -76.01 -43.91 38.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.628 0.371 . . . . 70.14 111.072 171.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -77.24 -2.46 34.81 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 112.936 0.717 . . . . 70.42 112.936 179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.5 m -58.44 -34.46 70.84 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-O 121.362 0.601 . . . . 73.21 111.412 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.653 ' HB2' ' HZ1' ' B' ' 60' ' ' LYS . 3.1 m-20 -116.1 106.76 48.85 Favored Pre-proline 0 CA--C 1.551 1.012 0 N-CA-C 108.049 -1.093 . . . . 71.51 108.049 171.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -74.92 -23.42 13.99 Favored 'Trans proline' 0 CA--C 1.557 1.672 0 C-N-CA 122.06 1.84 . . . . 74.43 113.175 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 m-20 -97.85 176.43 5.8 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.605 0.762 . . . . 61.14 111.593 -171.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.604 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.0 OUTLIER -89.56 26.28 1.76 Allowed 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 113.51 0.929 . . . . 71.35 113.51 -174.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 57.4 t -61.09 -51.77 69.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 C-N-CA 123.228 0.611 . . . . 75.11 111.09 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.7 pp -122.26 25.24 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.061 0.944 . . . . 64.42 111.856 178.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.602 ' HB2' ' HA ' ' B' ' 54' ' ' LEU . 24.5 ttt85 -48.9 -39.75 27.25 Favored 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.214 1.406 . . . . 63.2 114.086 -178.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -58.64 -46.78 86.36 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.815 0.846 . . . . 72.25 111.661 -177.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 15.3 ptm180 -83.31 -18.96 37.2 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 122.567 0.347 . . . . 50.24 111.738 176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.653 ' HZ1' ' HB2' ' B' ' 51' ' ' ASP . 23.9 ttmm -69.0 -47.32 65.8 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.406 0.682 . . . . 73.44 112.484 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.663 HG22 ' HD3' ' B' ' 27' ' ' PRO . 15.1 t -67.13 -30.0 47.94 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.007 -0.738 . . . . 64.31 109.007 172.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.52 -43.02 99.3 Favored Glycine 0 C--N 1.356 1.651 0 CA-C-N 115.252 -0.885 . . . . 73.31 113.287 173.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 23.9 m -75.52 -25.87 17.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 CA-C-N 117.89 0.845 . . . . 74.11 110.885 177.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.564 ' HA ' HD12 ' B' ' 67' ' ' ILE . 31.8 tp -62.11 -38.72 89.95 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.22 0.208 . . . . 71.32 111.369 169.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 80.7 mt -55.53 -40.01 71.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 122.538 0.335 . . . . 54.2 110.767 174.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . 0.405 ' HA ' ' HG3' ' B' ' 69' ' ' GLN . 8.3 m-20 -62.02 -45.81 91.97 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 123.768 0.827 . . . . 72.41 111.997 171.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' B' ' 44' ' ' ASP . 96.8 mt -56.73 -36.94 50.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 124.043 0.937 . . . . 64.02 111.874 177.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.589 HD13 ' HB2' ' B' ' 79' ' ' PHE . 79.6 mt -81.77 -44.72 16.61 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-N 115.458 -0.792 . . . . 60.31 112.199 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.405 ' HG3' ' HA ' ' B' ' 66' ' ' ASP . 0.0 OUTLIER -73.27 -20.58 60.8 Favored 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 113.064 0.764 . . . . 73.42 113.064 -175.855 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -64.85 -26.24 68.24 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 120.608 0.242 . . . . 74.51 111.447 177.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -87.76 -0.37 56.83 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.034 0.534 . . . . 74.33 111.122 176.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . 0.611 ' HA2' ' H ' ' B' ' 7' ' ' ASP . . . 88.39 -139.91 15.83 Favored Glycine 0 C--N 1.35 1.359 0 CA-C-N 115.964 -0.562 . . . . 31.24 113.468 -177.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.463 ' O ' HG23 ' B' ' 77' ' ' VAL . 47.9 t60 -68.56 -19.86 64.51 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 124.372 1.069 . . . . 73.1 110.951 175.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 4.4 mmmm -50.66 -56.42 11.94 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.304 1.042 . . . . 60.23 111.803 174.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.36 -30.98 77.61 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 114.047 0.379 . . . . 75.03 114.047 179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 79.0 t80 -56.49 -54.38 46.44 Favored 'General case' 0 CA--C 1.555 1.144 0 C-N-CA 123.36 0.664 . . . . 73.04 111.441 170.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.463 HG23 ' O ' ' B' ' 73' ' ' HIS . 46.6 t -58.2 -41.82 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.834 0.854 . . . . 54.22 110.981 175.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.02 -40.68 94.51 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.492 -0.776 . . . . 73.2 112.194 178.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.589 ' HB2' HD13 ' B' ' 68' ' ' LEU . 65.6 t80 -67.85 -42.95 80.59 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.233 0.213 . . . . 74.22 110.585 176.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 92.8 mt -58.09 -46.87 84.78 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 112.409 0.522 . . . . 64.53 112.409 176.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.16 -36.35 66.6 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 75.12 113.319 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 90.6 p -65.14 -44.45 88.61 Favored 'General case' 0 N--CA 1.483 1.22 0 N-CA-C 109.879 -0.415 . . . . 61.32 109.879 170.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' B' ' 87' ' ' TYR . 14.1 tp -65.22 -35.18 80.26 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.412 0.685 . . . . 62.3 111.554 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.501 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 10.5 tp10 -57.92 -42.88 85.69 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.544 1.138 . . . . 71.33 111.557 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -80.86 -55.22 4.95 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.431 0.692 . . . . 71.22 110.319 -179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -81.82 -43.2 18.6 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 114.279 1.214 . . . . 73.25 114.279 -168.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.528 ' HB3' HD23 ' B' ' 90' ' ' LEU . 71.3 m-85 -128.21 76.49 77.93 Favored Pre-proline 0 N--CA 1.496 1.826 0 CA-C-N 118.878 0.763 . . . . 64.1 111.298 -177.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -52.59 -51.17 11.74 Favored 'Trans proline' 0 C--N 1.381 2.286 0 C-N-CA 124.044 3.162 . . . . 74.21 114.964 -175.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.639 ' HG3' HD22 ' B' ' 90' ' ' LEU . 19.1 pt20 -64.85 -32.73 74.57 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 112.374 0.509 . . . . 71.13 112.374 -178.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.639 HD22 ' HG3' ' B' ' 89' ' ' GLN . 3.9 mm? -66.32 -40.63 90.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 122.936 0.494 . . . . 52.22 110.373 175.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 81.4 t80 -62.42 -46.35 88.97 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 116.121 -0.491 . . . . 74.4 110.695 173.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.701 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 14.5 mmmm -54.67 -43.29 72.3 Favored 'General case' 0 N--CA 1.481 1.09 0 N-CA-C 113.61 0.967 . . . . 72.55 113.61 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 16.6 ptpt -75.28 -40.93 58.2 Favored 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 112.585 0.587 . . . . 65.4 112.585 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.431 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.1 m -65.0 -40.04 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 112.52 0.563 . . . . 54.4 112.52 179.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -85.26 -40.56 16.47 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 122.708 0.403 . . . . 55.34 111.652 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 81.05 7.85 88.07 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.019 -0.537 . . . . 15.41 114.094 -178.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -139.21 173.63 11.36 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.803 0.841 . . . . 73.23 110.466 174.075 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.701 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 50.0 mm-40 -57.85 157.84 14.15 Favored Pre-proline 0 CA--C 1.564 1.493 0 C-N-CA 124.196 0.999 . . . . 72.23 113.691 -176.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -52.46 112.98 1.02 Allowed 'Trans proline' 0 C--N 1.388 2.615 0 C-N-CA 123.189 2.593 . . . . 64.31 113.797 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.63 -46.06 27.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.952 0.501 . . . . 42.12 110.262 178.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.69 ' HD3' ' SD ' ' A' ' 120' ' ' MET . 14.4 ttm180 60.9 54.03 3.6 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-N 114.717 -1.128 . . . . 72.11 110.914 173.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 8.4 t -81.1 48.19 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 C-N-CA 125.416 1.487 . . . . 70.14 110.71 -175.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' B' ' 115' ' ' LEU . 5.4 m-30 -61.19 1.0 0.2 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.788 1.235 . . . . 71.32 113.592 -179.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.9 m -61.6 -19.79 62.61 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.272 0.629 . . . . 75.01 110.454 169.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -50.53 -63.12 1.22 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 124.16 0.984 . . . . 74.23 111.395 167.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.541 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -76.42 -27.53 17.47 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 CA-C-N 115.51 -0.768 . . . . 62.44 110.424 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.493 HG12 ' O ' ' B' ' 103' ' ' PHE . 48.8 mm -62.06 -44.16 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 C-N-CA 122.657 0.383 . . . . 65.34 111.304 172.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -80.57 -28.87 37.08 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 121.985 -0.447 . . . . 64.34 111.901 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.09 -44.4 69.13 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.293 0.637 . . . . 65.31 112.429 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 46.4 m -123.17 -41.72 2.3 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 123.007 0.523 . . . . 72.41 112.032 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.57 165.81 10.42 Favored Glycine 0 N--CA 1.472 1.037 0 CA-C-N 115.972 -0.558 . . . . 30.43 112.548 -174.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.483 ' HA ' HD12 ' B' ' 107' ' ' ILE . 41.6 mt-10 -62.05 -48.06 81.93 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 123.133 0.573 . . . . 51.55 110.593 172.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -60.75 -29.16 69.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.533 0.733 . . . . 54.41 111.728 173.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.39 -58.01 16.81 Favored Glycine 0 C--N 1.356 1.677 0 O-C-N 123.114 0.259 . . . . 73.1 112.626 172.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.541 HD13 HG21 ' B' ' 106' ' ' ILE . 43.3 tp -63.34 -33.55 75.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.858 0.463 . . . . 74.52 111.918 176.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 67.5 m -62.2 -42.41 99.27 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.482 0.713 . . . . 73.05 111.395 176.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -68.39 -39.96 81.53 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 122.905 0.482 . . . . 72.04 111.944 173.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.546 HD23 ' HG3' ' B' ' 36' ' ' GLN . 2.8 tm? -60.54 -45.64 93.1 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.244 0.617 . . . . 60.3 110.589 176.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.561 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 83.3 mt -71.13 -40.76 71.22 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.564 0.746 . . . . 74.35 111.293 -178.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.545 ' O ' HG22 ' B' ' 123' ' ' VAL . 28.3 mmm -66.08 -36.66 83.78 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 112.865 0.691 . . . . 74.41 112.865 176.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.4 t -71.05 -35.82 72.07 Favored 'General case' 0 N--CA 1.479 1.001 0 O-C-N 121.49 -0.756 . . . . 70.51 109.889 172.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -62.82 -34.53 77.49 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.186 0.594 . . . . 73.43 111.993 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.545 HG22 ' O ' ' B' ' 120' ' ' MET . 3.3 m -64.73 -25.68 38.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 CA-C-N 118.297 0.499 . . . . 73.42 110.64 175.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.4 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 45.7 mtm -79.35 -38.77 34.29 Favored 'General case' 0 C--N 1.362 1.117 0 N-CA-C 109.892 -0.41 . . . . 65.32 109.892 -179.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.0 mmpt? -65.21 -37.68 88.08 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.864 0.865 . . . . 73.04 111.353 176.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.2 mt -72.62 -38.9 67.62 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 124.157 0.983 . . . . 53.42 111.013 174.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -64.82 -35.41 81.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.031 0.532 . . . . 62.14 110.927 175.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.4 ' HG2' ' O ' ' B' ' 124' ' ' MET . 74.6 mmtt -75.2 -34.89 61.55 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.222 0.609 . . . . 74.31 110.842 175.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.538 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.7 tptt -62.19 -43.74 98.15 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 123.102 0.561 . . . . 42.42 110.713 174.198 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.8 t -60.99 -46.73 96.07 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.157 0 C-N-CA 123.714 0.806 . . . . 72.34 111.024 177.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.6 pt20 -68.87 -30.73 69.31 Favored 'General case' 0 N--CA 1.486 1.352 0 O-C-N 122.22 -0.3 . . . . 70.51 111.159 178.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 30.1 t70 -63.86 -39.24 93.73 Favored 'General case' 0 C--N 1.353 0.744 0 C-N-CA 123.481 0.712 . . . . 72.22 110.818 176.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.665 HD13 ' HB ' ' A' ' 134' ' ' THR . 22.9 mt -79.98 -38.56 31.95 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 115.995 -0.548 . . . . 71.32 111.101 -176.351 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -69.82 -26.2 64.12 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.478 0.177 . . . . 62.33 111.478 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.34 -46.89 75.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.388 0.675 . . . . 74.32 110.92 173.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.523 ' HB2' HD11 ' A' ' 137' ' ' LEU . 58.4 mt -74.25 -27.15 60.62 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.3 0.64 . . . . 71.32 112.008 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.494 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.8 tt -71.95 -51.55 21.5 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 109.109 -0.7 . . . . 72.41 109.109 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 32.5 t -65.86 -23.57 66.69 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.689 0.796 . . . . 74.12 112.34 177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.1 t -147.08 92.82 2.17 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.24 0.616 . . . . 70.11 111.067 178.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 10.0 mtpm? -84.9 -162.75 0.73 Allowed 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 123.721 0.808 . . . . 71.24 111.583 172.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -57.59 -35.6 70.62 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 123.749 0.82 . . . . 51.42 111.628 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.6 t70 . . . . . 0 C--O 1.252 1.206 0 C-N-CA 124.461 1.104 . . . . 72.2 108.688 171.57 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 N-CA-C 113.965 0.346 . . . . 74.14 113.965 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -126.34 -177.07 3.85 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.694 0.798 . . . . 73.52 111.342 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -83.95 153.29 24.0 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.1 0.56 . . . . 72.41 111.882 176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -67.68 -27.13 66.58 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.851 0.86 . . . . 63.31 111.406 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -99.38 151.61 20.89 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.487 1.115 . . . . 54.42 110.192 174.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -156.88 -64.85 0.1 Allowed 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.796 0.439 . . . . 72.04 111.675 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -133.41 -2.54 3.08 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 123.17 0.588 . . . . 73.33 111.745 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.442 ' O ' ' HB2' ' A' ' 11' ' ' TRP . 5.9 p-10 -59.72 -11.94 6.12 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.952 0.901 . . . . 74.54 112.803 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -49.06 -37.58 21.52 Favored 'General case' 0 CA--C 1.565 1.538 0 C-N-CA 124.461 1.104 . . . . 64.43 113.132 171.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 7.4 p -67.16 -28.03 67.78 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 112.704 0.631 . . . . 71.05 112.704 178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.481 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 47.4 m95 -56.51 -17.56 8.72 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.248 1.203 . . . . 75.1 114.248 171.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.6 t -56.24 -31.62 63.71 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.027 0.531 . . . . 63.21 112.082 175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -60.45 -39.36 80.88 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 124.514 1.125 . . . . 74.31 111.513 174.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 81.7 mt -81.72 -32.3 31.66 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.557 0.743 . . . . 72.25 111.797 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -51.73 -50.79 59.88 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.941 1.296 . . . . 72.43 113.041 -176.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.18 -22.08 48.77 Favored Glycine 0 CA--C 1.539 1.574 0 N-CA-C 114.247 0.459 . . . . 74.12 114.247 177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -106.65 1.75 25.38 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 118.496 -0.764 . . . . 71.22 112.595 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 70.5 mtp180 -55.5 -33.19 63.51 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.214 0.82 . . . . 61.45 113.214 -177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -56.64 -35.98 46.99 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.685 0 C-N-CA 123.53 0.732 . . . . 64.01 111.931 175.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 38.2 m -88.69 -37.46 15.53 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.143 0.977 . . . . 51.5 111.631 178.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.487 HD23 HD12 ' A' ' 90' ' ' LEU . 91.5 mt -60.15 -38.03 81.88 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.458 0.703 . . . . 63.34 111.283 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.681 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.2 p -73.98 -27.51 61.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.003 0.521 . . . . 74.21 112.059 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.52 ' HA ' ' HE2' ' A' ' 58' ' ' LYS . 22.6 t -81.78 -29.66 32.64 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.766 0.826 . . . . 71.13 112.931 -177.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.57 HG11 HD21 ' A' ' 90' ' ' LEU . 46.8 t -99.57 -49.44 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.527 0 CA-C-O 121.294 0.569 . . . . 73.13 112.104 -179.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.471 HD13 HD11 ' A' ' 83' ' ' LEU . 37.2 mt -84.61 142.81 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.927 0 CA-C-N 115.746 -0.661 . . . . 73.41 111.286 -170.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -122.35 116.86 29.45 Favored Pre-proline 0 C--O 1.249 1.047 0 C-N-CA 123.762 0.825 . . . . 72.35 109.429 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.676 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 81.5 Cg_exo -51.26 -26.1 19.48 Favored 'Trans proline' 0 C--N 1.387 2.589 0 C-N-CA 123.964 3.109 . . . . 65.41 114.594 -175.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 66.7 p -63.63 -34.0 76.87 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.38 0.672 . . . . 62.52 111.49 -176.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -95.08 -7.2 40.18 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 113.023 0.749 . . . . 75.22 113.023 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.454 HG12 ' HA ' ' A' ' 27' ' ' PRO . 36.9 pt -113.72 -20.13 6.33 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 112.363 0.505 . . . . 72.12 112.363 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.6 p -61.02 -40.96 78.86 Favored Pre-proline 0 N--CA 1.498 1.95 0 CA-C-O 118.019 -0.991 . . . . 51.3 113.111 179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.436 ' O ' ' HG3' ' A' ' 36' ' ' GLN . 31.9 Cg_exo -60.9 -34.9 90.43 Favored 'Trans proline' 0 C--N 1.395 3.016 0 C-N-CA 121.725 1.617 . . . . 64.4 112.402 171.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -69.74 -40.19 76.33 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.069 0.548 . . . . 71.14 112.393 179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.461 HD13 HD21 ' A' ' 68' ' ' LEU . 43.9 mt -66.56 -23.81 66.26 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.598 0.759 . . . . 74.13 111.573 174.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.443 ' HG2' HD22 ' A' ' 40' ' ' LEU . 1.1 mmp_? -70.27 -44.5 68.3 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.662 0.785 . . . . 64.22 110.507 170.472 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.622 ' NE2' HD13 ' A' ' 118' ' ' LEU . 18.1 mt-30 -58.78 -38.6 78.9 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 124.062 0.945 . . . . 72.24 111.26 175.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.3 m -78.4 -6.06 54.12 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 124.2 1.0 . . . . 74.01 112.113 176.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.431 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.2 mmtt 66.31 12.74 8.81 Favored 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 125.175 1.39 . . . . 73.31 114.036 173.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.6 m -88.64 -32.28 5.84 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.101 0.56 . . . . 63.51 111.148 -179.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.443 HD22 ' HG2' ' A' ' 35' ' ' ARG . 8.9 tt -89.88 141.52 28.56 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 124.608 1.163 . . . . 75.12 109.968 176.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 24.6 m-80 -103.74 151.21 38.76 Favored Pre-proline 0 N--CA 1.493 1.705 0 C-N-CA 124.424 1.09 . . . . 72.34 110.009 174.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -50.11 -27.14 16.33 Favored 'Trans proline' 0 N--CA 1.509 2.414 0 C-N-CA 123.597 2.865 . . . . 54.23 114.623 -179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.93 -44.83 94.99 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.299 1.04 . . . . 73.22 112.486 174.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 52.1 m-20 -66.08 -57.21 8.23 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.786 0.834 . . . . 74.43 112.517 -173.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.407 ' H ' HD21 ' A' ' 40' ' ' LEU . 13.2 pt-20 -48.32 -40.11 24.11 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 113.103 0.779 . . . . 71.35 113.103 174.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -80.12 -32.31 39.04 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 122.012 -0.43 . . . . 70.5 112.028 -176.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -76.07 -34.13 59.57 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 118.379 0.536 . . . . 74.1 111.792 177.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.32 -37.36 75.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.833 0.853 . . . . 74.12 110.714 174.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -101.75 23.79 10.81 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.581 0.753 . . . . 71.54 112.416 178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 53.9 m -61.11 -36.04 78.63 Favored 'General case' 0 N--CA 1.504 2.26 0 CA-C-O 121.675 0.75 . . . . 53.0 111.108 170.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -98.87 119.9 59.96 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.231 1.413 . . . . 73.24 109.196 172.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_endo -74.88 -42.75 0.49 Allowed 'Trans proline' 0 C--N 1.378 2.079 0 C-N-CA 122.921 2.414 . . . . 74.43 115.491 -169.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 51.2 m-20 -69.48 173.94 5.43 Favored 'General case' 0 N--CA 1.494 1.764 0 N-CA-C 112.791 0.663 . . . . 71.45 112.791 -173.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -116.56 26.17 10.06 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.871 0.468 . . . . 73.21 112.22 177.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 44.9 t -69.2 -27.2 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 CA-C-O 121.177 0.513 . . . . 63.23 110.281 173.453 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 21.5 pt -116.62 27.35 3.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.5 0 C-N-CA 124.461 1.105 . . . . 71.23 112.149 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.406 ' HB3' ' HB2' ' A' ' 54' ' ' LEU . 2.4 ptm180 -55.57 -25.0 35.74 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 113.999 1.111 . . . . 71.4 113.999 178.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.595 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 31.2 mmtp -64.63 -42.92 95.17 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 122.924 0.489 . . . . 65.41 111.798 179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.1 ptm85 -76.96 -27.9 54.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 122.054 0.142 . . . . 74.31 110.988 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 24.4 ttmm -64.08 -43.71 94.59 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.518 0.727 . . . . 55.22 111.458 -178.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.681 ' HB ' HG22 ' A' ' 22' ' ' THR . 39.9 t -69.17 -48.53 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 N-CA-C 109.767 -0.457 . . . . 52.03 109.767 173.134 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -55.36 -40.62 77.21 Favored Glycine 0 C--N 1.353 1.512 0 N-CA-C 114.947 0.739 . . . . 34.04 114.947 -175.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.3 m -75.76 -32.23 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 122.564 0.346 . . . . 73.12 111.161 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.545 HD22 ' HB3' ' A' ' 27' ' ' PRO . 57.0 tp -66.64 -38.14 86.28 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 122.93 0.492 . . . . 75.04 110.958 174.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 76.6 mt -60.46 -41.63 94.53 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.422 0.689 . . . . 74.53 110.788 175.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -61.99 -39.44 92.21 Favored 'General case' 0 CA--C 1.561 1.403 0 C-N-CA 123.946 0.898 . . . . 72.51 111.825 172.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.08 -33.51 63.67 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.433 0 C-N-CA 124.042 0.937 . . . . 74.32 112.236 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.461 HD21 HD13 ' A' ' 34' ' ' LEU . 93.0 mt -83.44 -32.29 26.15 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 74.43 112.503 -179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -70.45 -19.63 62.95 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 112.634 0.605 . . . . 74.21 112.634 -175.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 ptt180 -71.35 -25.23 62.3 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.178 0.591 . . . . 71.25 111.373 -179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -83.78 1.44 42.88 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.449 0.7 . . . . 34.32 110.983 172.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.59 -116.98 8.82 Favored Glycine 0 C--N 1.352 1.43 0 C-N-CA 123.524 0.583 . . . . 74.52 114.499 179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -74.59 -24.62 58.92 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.157 0.583 . . . . 75.22 111.374 -177.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.0 mmmm -55.36 -62.46 1.66 Allowed 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.394 0.678 . . . . 73.31 112.166 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.34 -34.78 90.87 Favored Glycine 0 N--CA 1.474 1.226 0 CA-C-N 115.915 -0.584 . . . . 61.24 113.214 178.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -54.93 -58.85 5.93 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.793 0.837 . . . . 63.03 111.848 172.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.6 t -59.48 -39.41 79.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.809 0.844 . . . . 52.11 111.07 177.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.24 -39.25 94.07 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 112.732 0.642 . . . . 75.13 112.732 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -68.31 -46.1 71.17 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 122.974 0.509 . . . . 72.43 110.44 175.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.24 -43.05 82.57 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.617 0.367 . . . . 61.01 110.908 175.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -58.57 -49.72 76.42 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.741 1.616 . . . . 72.11 111.563 178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 96.9 p -63.07 -32.86 74.33 Favored 'General case' 0 N--CA 1.486 1.354 0 CA-C-N 115.746 -0.661 . . . . 71.42 111.481 176.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 25' ' ' ILE . 10.7 mp -74.25 -34.42 63.62 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.921 -0.487 . . . . 75.23 112.146 173.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.85 -20.23 64.28 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.664 -0.648 . . . . 74.2 111.509 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.9 tt -93.96 -61.75 1.48 Allowed 'General case' 0 CA--C 1.566 1.565 0 C-N-CA 123.445 0.698 . . . . 73.32 110.533 171.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 73.3 m-85 -78.62 -50.21 11.89 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.14 1.163 . . . . 74.13 114.14 -171.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -125.38 77.92 68.05 Favored Pre-proline 0 N--CA 1.498 1.932 0 CA-C-N 118.659 0.663 . . . . 71.13 112.278 -172.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.21 -33.38 90.45 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 122.661 2.241 . . . . 73.31 113.829 -175.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -74.57 -32.87 62.53 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.234 0.457 . . . . 71.11 112.234 177.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.57 HD21 HG11 ' A' ' 24' ' ' VAL . 4.4 mm? -65.63 -40.45 92.55 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 122.519 0.328 . . . . 71.42 110.697 174.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -64.05 -48.41 76.37 Favored 'General case' 0 CA--C 1.553 1.087 0 CA-C-O 120.759 0.314 . . . . 73.1 110.25 172.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 52.2 tptt -52.7 -38.8 61.25 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.267 1.027 . . . . 71.32 113.057 177.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -82.09 -41.69 20.2 Favored 'General case' 0 N--CA 1.485 1.281 0 CA-C-N 118.615 0.643 . . . . 75.32 112.725 179.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' A' ' 95' ' ' THR . 25.0 m -64.21 -30.99 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 CA-C-N 118.534 0.606 . . . . 74.02 112.439 178.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' A' ' 94' ' ' VAL . 68.5 p -99.88 -45.11 5.82 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.881 0.472 . . . . 62.14 112.153 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.35 -4.41 37.78 Favored Glycine 0 N--CA 1.476 1.305 0 CA-C-N 116.237 -0.438 . . . . 42.33 113.1 -174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.44 168.34 19.98 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.801 0.841 . . . . 71.11 111.485 179.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -64.57 158.06 69.62 Favored Pre-proline 0 N--CA 1.487 1.422 0 C-N-CA 123.909 0.884 . . . . 74.21 112.216 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -46.66 118.11 2.44 Favored 'Trans proline' 0 C--N 1.379 2.158 0 C-N-CA 122.808 2.339 . . . . 62.32 113.258 165.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.54 -21.3 45.37 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.388 0.675 . . . . 62.45 110.328 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 73.42 53.25 0.12 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.678 1.591 . . . . 71.13 109.002 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.9 t -77.13 38.36 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.743 0 C-N-CA 124.008 0.923 . . . . 74.43 111.824 -178.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -65.29 1.41 1.08 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 124.337 1.055 . . . . 74.41 113.833 -176.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 88.7 p -59.8 -28.47 67.47 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.165 0.986 . . . . 62.55 111.569 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 11.0 tpt -65.62 -61.4 2.11 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 124.277 1.031 . . . . 63.44 111.257 176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.743 HD12 HD13 ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.3 -28.33 44.22 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.785 0 C-N-CA 123.197 0.599 . . . . 63.32 111.05 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.488 HD11 HG21 ' B' ' 116' ' ' THR . 18.1 mm -64.13 -47.26 90.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 C-N-CA 123.625 0.77 . . . . 74.15 111.075 169.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -68.18 -28.54 67.36 Favored 'General case' 0 CA--C 1.558 1.284 0 O-C-N 121.971 -0.456 . . . . 70.11 111.389 178.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.431 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -78.43 -62.64 1.62 Allowed 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.903 0.881 . . . . 75.42 113.17 -177.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 94.4 p -97.98 -5.43 34.17 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.293 0.637 . . . . 33.21 112.636 -176.001 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 95.65 160.97 33.33 Favored Glycine 0 N--CA 1.479 1.552 0 C-N-CA 122.566 0.127 . . . . 70.43 113.031 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.419 ' HA ' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.45 -53.92 40.69 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.801 0.44 . . . . 75.44 110.844 175.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.5 p -61.05 -28.97 69.45 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.242 0.617 . . . . 73.22 111.512 173.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.6 -61.65 7.15 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-O 119.849 -0.417 . . . . 62.22 112.523 172.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.743 HD13 HD12 ' A' ' 106' ' ' ILE . 50.6 tp -63.36 -29.09 70.46 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.057 0.543 . . . . 73.44 111.991 177.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.44 HG21 HD11 ' B' ' 107' ' ' ILE . 52.6 m -60.11 -51.59 68.96 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.909 0.484 . . . . 73.24 110.586 173.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.447 ' HG2' ' NH2' ' B' ' 101' ' ' ARG . 48.2 mt-30 -67.56 -35.98 80.06 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.206 0.602 . . . . 74.11 112.142 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.622 HD13 ' NE2' ' A' ' 36' ' ' GLN . 51.0 mt -62.89 -52.41 63.19 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.81 0.844 . . . . 61.11 112.151 176.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.507 ' O ' HG13 ' A' ' 123' ' ' VAL . 85.9 mt -62.06 -45.7 92.4 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 122.924 0.49 . . . . 61.44 110.61 175.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.47 ' O ' HG22 ' A' ' 123' ' ' VAL . 6.8 tpt -51.84 -44.68 63.69 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.417 1.087 . . . . 72.11 113.374 176.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 10.1 t -73.73 -39.17 64.47 Favored 'General case' 0 N--CA 1.485 1.298 0 O-C-N 121.635 -0.666 . . . . 70.43 111.659 174.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -65.53 -26.51 67.92 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.264 0.839 . . . . 72.15 113.264 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.507 HG13 ' O ' ' A' ' 119' ' ' LEU . 14.0 m -70.99 -25.92 26.64 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 CA-C-N 118.162 0.437 . . . . 74.53 110.117 173.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.486 ' O ' ' HD3' ' A' ' 128' ' ' LYS . 38.9 mtm -81.77 -37.53 27.04 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 122.939 0.495 . . . . 64.33 109.92 178.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -58.11 -53.43 58.39 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.605 0.762 . . . . 73.22 111.032 172.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.4 mt -57.24 -41.6 79.88 Favored 'General case' 0 CA--C 1.55 0.945 0 CA-C-N 114.796 -1.093 . . . . 73.25 112.638 171.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.9 tp-100 -60.51 -34.56 74.27 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.191 0.596 . . . . 73.23 111.741 175.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.486 ' HD3' ' O ' ' A' ' 124' ' ' MET . 13.3 mptt -78.49 -28.87 46.44 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.337 0.655 . . . . 44.41 111.059 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -68.56 -30.65 69.47 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 122.843 0.457 . . . . 73.31 110.742 169.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.526 HG13 HD11 ' B' ' 133' ' ' LEU . 57.1 t -72.81 -45.12 57.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.02 0 C-N-CA 123.413 0.685 . . . . 62.11 110.295 174.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.482 ' HA ' HG22 ' A' ' 134' ' ' THR . 6.4 pt20 -63.38 -33.29 75.22 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 117.605 0.184 . . . . 73.41 110.551 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.9 t0 -58.46 -63.01 1.43 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 123.709 0.804 . . . . 54.32 110.21 175.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.414 ' O ' ' HB2' ' A' ' 137' ' ' LEU . 12.3 mt -65.78 -32.86 74.64 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 112.49 0.552 . . . . 75.35 112.49 -174.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.482 HG22 ' HA ' ' A' ' 131' ' ' GLN . 3.4 t -72.01 -31.67 66.42 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 122.2 0.2 . . . . 74.54 111.136 178.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.57 -40.3 76.85 Favored 'General case' 0 N--CA 1.484 1.264 0 CA-C-O 121.066 0.46 . . . . 42.54 111.279 172.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.6 mt -72.61 -24.96 61.15 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.694 0.797 . . . . 63.34 111.306 176.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.557 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.8 tt -79.2 -40.34 31.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.016 0.927 . . . . 45.45 108.658 175.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.5 t -65.22 -40.66 94.4 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.704 0.802 . . . . 61.13 111.914 178.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 66.6 p -132.04 76.72 1.72 Allowed 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.548 0.739 . . . . 74.34 110.5 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -78.76 161.84 26.56 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.261 0.624 . . . . 71.41 111.09 177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -54.24 -19.6 5.53 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 114.369 1.248 . . . . 62.43 114.369 -178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 . . . . . 0 CA--C 1.57 1.724 0 C-N-CA 123.335 0.654 . . . . 73.44 111.208 176.446 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.139 0 CA-C-O 120.258 -0.19 . . . . 64.41 112.871 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 73.2 m -140.17 176.84 8.42 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.712 0.805 . . . . 74.14 111.141 -178.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -72.16 136.65 46.54 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.064 0.546 . . . . 72.11 111.29 179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -85.44 -48.88 8.56 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.893 0.877 . . . . 75.11 110.658 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -72.76 93.28 1.64 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.749 0.785 . . . . 72.3 111.809 -178.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 26.6 m-80 -126.7 -157.77 0.82 Allowed 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.803 1.241 . . . . 64.42 107.765 170.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -132.31 44.99 2.82 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 122.871 1.32 . . . . 63.54 110.011 165.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -66.95 -16.11 64.13 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 115.478 -0.783 . . . . 72.04 111.415 169.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -69.75 -19.09 63.54 Favored 'General case' 0 CA--C 1.56 1.34 0 C-N-CA 124.21 1.004 . . . . 73.53 112.264 171.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 6.4 t -55.03 -35.62 64.63 Favored 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 124.42 1.088 . . . . 72.12 110.668 172.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.478 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 64.4 m95 -55.12 -15.74 2.47 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 115.802 1.779 . . . . 73.23 115.802 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 32.1 t -44.69 -34.11 2.1 Favored 'General case' 0 N--CA 1.506 2.338 0 N-CA-C 114.818 1.414 . . . . 63.52 114.818 -172.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.97 -42.74 97.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 124.444 1.098 . . . . 75.23 112.496 175.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.6 mt -84.31 -32.15 24.47 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 123.99 0.916 . . . . 75.22 111.896 177.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -50.35 -58.75 4.97 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.77 1.628 . . . . 75.44 112.974 -176.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -69.58 3.63 8.39 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 114.386 0.514 . . . . 65.25 114.386 177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -118.84 10.64 12.38 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.703 0.801 . . . . 74.53 111.898 174.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.525 ' NH2' HE22 ' B' ' 69' ' ' GLN . 73.6 mtt180 -49.6 -43.85 46.68 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 118.63 0.65 . . . . 61.41 112.011 177.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.54 -40.16 24.49 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.501 0 C-N-CA 123.623 0.769 . . . . 75.42 112.768 178.575 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 4.8 m -82.41 -40.29 21.46 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.979 0.512 . . . . 50.45 111.019 -179.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.606 ' HA ' HD13 ' B' ' 25' ' ' ILE . 89.0 mt -61.29 -42.02 97.95 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.201 0.6 . . . . 75.42 111.268 179.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.582 HG22 ' HB ' ' B' ' 61' ' ' VAL . 60.9 p -79.47 7.12 8.67 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 124.741 1.217 . . . . 74.33 113.533 179.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -119.81 -36.34 3.32 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.794 0.838 . . . . 62.53 110.128 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.659 HG11 HD21 ' B' ' 90' ' ' LEU . 97.1 t -96.88 -49.92 11.75 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 115.177 -0.92 . . . . 51.11 112.852 -177.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.606 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.2 mp -80.23 145.24 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 C-N-CA 122.928 0.491 . . . . 71.23 110.579 -173.571 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.44 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 30.5 t0 -124.04 110.18 29.32 Favored Pre-proline 0 CA--C 1.551 0.996 0 N-CA-C 109.146 -0.687 . . . . 71.51 109.146 172.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.693 ' HD3' HG22 ' B' ' 61' ' ' VAL . 89.1 Cg_exo -48.64 -23.75 5.85 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 124.28 3.32 . . . . 75.24 115.708 -177.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.482 ' HB3' HD11 ' B' ' 49' ' ' LEU . 96.5 p -72.57 -20.99 61.22 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-N 118.149 0.432 . . . . 60.45 111.123 -174.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.44 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.7 ptm180 -88.94 -24.79 22.36 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.281 0.232 . . . . 72.33 111.42 177.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.1 pt -104.84 -10.34 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 N-CA-C 112.588 0.588 . . . . 71.22 112.588 -175.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.601 HG22 HD11 ' B' ' 40' ' ' LEU . 1.6 p -53.05 -49.96 84.62 Favored Pre-proline 0 N--CA 1.497 1.894 0 CA-C-O 118.176 -0.916 . . . . 74.42 113.149 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -66.1 -31.8 44.84 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.782 1.655 . . . . 72.33 113.431 -178.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -65.96 -49.61 67.27 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.852 0.461 . . . . 74.21 110.483 174.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.7 mt -65.68 -21.94 66.59 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.61 0.764 . . . . 71.5 112.561 179.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -63.75 -50.06 70.57 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.058 0.543 . . . . 61.54 110.211 168.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.555 ' HG3' HD11 ' B' ' 118' ' ' LEU . 0.0 OUTLIER -63.68 -28.89 70.21 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.763 0.825 . . . . 70.3 112.021 176.604 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 53.4 m -73.31 -13.3 61.09 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.737 0.815 . . . . 60.21 111.845 172.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.448 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.7 mmtt 70.56 13.65 7.34 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.385 1.474 . . . . 61.23 112.851 175.338 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -97.31 -37.37 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.165 0.586 . . . . 74.21 111.418 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.659 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.08 133.43 37.56 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.929 0.892 . . . . 71.24 109.555 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -112.43 161.09 27.83 Favored Pre-proline 0 N--CA 1.48 1.049 0 C-N-CA 124.653 1.181 . . . . 70.21 110.517 -177.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -56.22 -26.24 60.03 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 122.495 2.13 . . . . 51.55 114.16 178.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -69.17 -47.46 64.89 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 123.081 0.552 . . . . 75.15 110.944 173.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -57.95 -42.85 85.81 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.894 0.878 . . . . 54.02 111.936 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.659 ' HB3' HD21 ' B' ' 40' ' ' LEU . 7.0 pt-20 -77.06 -34.12 57.16 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 119.418 -0.325 . . . . 70.22 111.411 -176.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.97 -36.41 69.82 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 118.129 0.422 . . . . 73.52 111.128 179.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -75.34 -43.9 48.17 Favored 'General case' 0 N--CA 1.483 1.224 0 CA-C-N 117.974 0.352 . . . . 75.33 111.584 176.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.59 HG22 HG23 ' B' ' 63' ' ' VAL . 53.5 t -62.78 -39.98 86.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 C-N-CA 123.153 0.581 . . . . 70.14 111.16 178.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.482 HD11 ' HB3' ' B' ' 28' ' ' SER . 3.4 mm? -99.62 48.18 0.94 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.232 0.613 . . . . 70.42 111.467 174.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.3 m -63.25 -33.33 75.26 Favored 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 121.746 0.784 . . . . 73.21 109.492 161.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -104.24 107.65 58.01 Favored Pre-proline 0 CA--C 1.555 1.171 0 C-N-CA 125.007 1.323 . . . . 71.51 108.384 164.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -74.21 -28.58 10.55 Favored 'Trans proline' 0 CA--C 1.555 1.529 0 C-N-CA 121.848 1.699 . . . . 74.43 112.752 172.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -61.04 -87.87 0.01 OUTLIER 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.046 0.939 . . . . 61.14 113.484 -177.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.401 ' H ' ' H ' ' B' ' 55' ' ' VAL . 2.4 pt? 178.52 -7.89 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 122.967 0.507 . . . . 71.35 111.684 -170.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.401 ' H ' ' H ' ' B' ' 54' ' ' LEU . 62.3 t -56.47 -39.28 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.351 0 C-N-CA 124.347 1.059 . . . . 75.11 113.06 -168.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.403 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 27.2 pt -112.12 23.97 4.48 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 N-CA-C 113.562 0.949 . . . . 64.42 113.562 -172.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.496 ' HA ' ' HB3' ' B' ' 60' ' ' LYS . 97.4 mtt180 -51.75 -25.45 7.53 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 114.516 1.302 . . . . 63.2 114.516 -175.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.488 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 50.6 mmtt -62.55 -53.54 53.23 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.47 0.544 . . . . 72.25 112.47 173.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 17.4 ptp180 -80.05 -22.45 42.32 Favored 'General case' 0 C--O 1.202 -1.396 0 O-C-N 121.745 -0.597 . . . . 50.24 110.943 176.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.52 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 21.9 ttmm -64.1 -50.98 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 124.13 0.972 . . . . 73.44 111.84 -175.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.693 HG22 ' HD3' ' B' ' 27' ' ' PRO . 18.1 t -72.15 -39.01 64.54 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 N-CA-C 109.905 -0.405 . . . . 64.31 109.905 174.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.05 -39.17 95.36 Favored Glycine 0 C--N 1.352 1.446 0 O-C-N 123.406 0.441 . . . . 73.31 114.024 -177.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.59 HG23 HG22 ' B' ' 48' ' ' VAL . 33.3 m -77.62 -32.88 18.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.825 0 C-N-CA 122.993 0.517 . . . . 74.11 110.784 176.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.418 HD11 HD12 ' B' ' 40' ' ' LEU . 59.2 tp -58.83 -48.89 79.74 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.817 0.447 . . . . 71.32 111.009 173.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.478 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 75.7 mt -57.89 -52.08 66.96 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.754 0.822 . . . . 54.2 109.988 175.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -50.99 -47.68 61.44 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 125.111 1.365 . . . . 72.41 112.54 177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -55.1 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 123.883 0.873 . . . . 64.02 110.693 177.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.462 ' HB3' ' HA3' ' B' ' 75' ' ' GLY . 81.2 mt -63.89 -19.06 64.8 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 113.187 0.81 . . . . 60.31 113.187 -178.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.525 HE22 ' NH2' ' B' ' 18' ' ' ARG . 65.1 mt-30 -62.6 -20.27 64.57 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 113.071 0.767 . . . . 73.42 113.071 170.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 17.1 ptt180 -67.89 -29.29 68.35 Favored 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 118.063 0.392 . . . . 74.51 110.894 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 51.6 p -88.22 -4.48 58.71 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.194 0.598 . . . . 74.33 111.569 176.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.76 -105.04 0.58 Allowed Glycine 0 C--N 1.356 1.656 0 C-N-CA 123.51 0.576 . . . . 31.24 114.284 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 11.6 t60 -66.74 -36.01 81.45 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.985 0.914 . . . . 73.1 112.13 -177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.563 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 10.9 mmmm -58.07 -62.69 1.64 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 124.161 0.984 . . . . 60.23 112.165 -176.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . 0.462 ' HA3' ' HB3' ' B' ' 68' ' ' LEU . . . -62.82 -36.27 93.13 Favored Glycine 0 C--N 1.347 1.142 0 CA-C-N 116.083 -0.508 . . . . 75.03 113.129 -178.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.9 t80 -53.64 -63.3 1.19 Allowed 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.17 0.988 . . . . 73.04 112.552 172.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 88.2 t -60.59 -36.68 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 C-N-CA 123.426 0.69 . . . . 54.22 111.692 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.45 99.23 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.034 0.533 . . . . 73.2 112.024 175.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 50.7 t80 -69.96 -37.34 75.77 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 119.552 -0.261 . . . . 74.22 110.411 177.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.482 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 97.2 mt -55.81 -60.09 3.95 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.859 0.464 . . . . 64.53 111.597 173.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -64.2 -36.41 83.99 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.096 0.558 . . . . 75.12 112.464 -176.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 89.4 p -63.78 -44.67 92.69 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.868 -0.419 . . . . 61.32 109.868 173.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.3 tp -63.21 -36.44 83.67 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.18 0.592 . . . . 62.3 111.578 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 88.2 mt-10 -60.94 -30.08 70.01 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.494 0.718 . . . . 71.33 111.878 176.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.543 HD12 ' HE1' ' B' ' 103' ' ' PHE . 7.4 tt -84.89 -52.4 6.03 Favored 'General case' 0 CA--C 1.563 1.461 0 C-N-CA 124.001 0.92 . . . . 71.22 110.952 178.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -83.01 -48.75 10.29 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 113.733 1.012 . . . . 73.25 113.733 -172.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.562 ' HB3' HD23 ' B' ' 90' ' ' LEU . 82.0 m-85 -132.98 82.45 54.91 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.892 -0.505 . . . . 64.1 111.593 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -62.35 -37.84 58.03 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 123.689 2.926 . . . . 74.21 114.243 -174.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.407 ' HG3' HD22 ' B' ' 90' ' ' LEU . 12.4 pt20 -66.44 -27.08 67.55 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.353 0.661 . . . . 71.13 111.779 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.659 HD21 HG11 ' B' ' 24' ' ' VAL . 3.9 mm? -72.18 -36.72 69.34 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.486 0.314 . . . . 52.22 110.538 176.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.442 ' HA ' HG22 ' B' ' 94' ' ' VAL . 59.7 t80 -65.78 -43.9 87.42 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 120.796 0.331 . . . . 74.4 110.158 171.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' B' ' 97' ' ' LYS . 56.6 tptt -50.31 -48.53 55.14 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.2 1.0 . . . . 72.55 112.408 174.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -70.9 -44.67 65.77 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 112.488 0.551 . . . . 65.4 112.488 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.474 HG23 HG23 ' B' ' 95' ' ' THR . 21.1 m -63.02 -40.48 89.21 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 CA-C-N 118.676 0.671 . . . . 54.4 112.703 -176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.474 HG23 HG23 ' B' ' 94' ' ' VAL . 69.3 p -93.12 -41.81 9.74 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 112.403 0.52 . . . . 55.34 112.403 -178.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 113.32 -11.66 24.0 Favored Glycine 0 CA--C 1.536 1.405 0 CA-C-N 116.211 -0.449 . . . . 15.41 112.26 -174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . 0.419 ' O ' ' HA ' ' B' ' 92' ' ' LYS . 0.0 OUTLIER -138.18 170.89 15.23 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.705 0.802 . . . . 73.23 111.832 -177.452 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 5.6 mp0 -63.65 160.65 42.44 Favored Pre-proline 0 N--CA 1.49 1.534 0 C-N-CA 123.609 0.764 . . . . 72.23 112.037 -178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.415 ' HB3' ' HB3' ' B' ' 84' ' ' GLU . 4.0 Cg_exo -35.27 112.09 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.526 0 C-N-CA 124.131 3.221 . . . . 64.31 115.544 169.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.24 -19.56 62.35 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 124.081 0.952 . . . . 42.12 111.305 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.447 ' NH2' ' HG2' ' A' ' 117' ' ' GLN . 7.4 ptm180 69.84 45.17 0.77 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 127.073 2.149 . . . . 72.11 111.104 170.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.7 t -81.39 44.63 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.57 1.725 0 CA-C-O 122.106 0.955 . . . . 70.14 111.382 178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.543 ' HE1' HD12 ' B' ' 85' ' ' LEU . 7.0 m-85 -67.4 -4.39 10.98 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.166 0.986 . . . . 71.32 112.517 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 68.3 p -60.75 -21.82 63.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.95 0.9 . . . . 75.01 111.192 173.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.2 tpt -63.06 -61.86 2.1 Favored 'General case' 0 CA--C 1.558 1.269 0 C-N-CA 124.634 1.174 . . . . 74.23 111.412 174.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.78 -33.22 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 C-N-CA 123.488 0.715 . . . . 62.44 111.503 176.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.44 HD11 HG21 ' A' ' 116' ' ' THR . 28.5 mm -56.64 -49.59 77.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 C-N-CA 123.579 0.752 . . . . 65.34 111.017 171.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -71.17 -34.6 71.1 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.342 0.657 . . . . 64.34 111.774 179.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.448 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -70.46 -58.6 3.54 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.044 0.938 . . . . 65.31 112.693 -174.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 81.2 p -102.95 -40.6 6.44 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.145 0.578 . . . . 72.41 112.246 -177.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 139.73 155.44 6.61 Favored Glycine 0 CA--C 1.535 1.288 0 CA-C-N 116.579 -0.282 . . . . 30.43 112.928 -174.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -59.29 -49.22 78.68 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.453 0.701 . . . . 51.55 111.402 174.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 72.2 p -60.86 -31.79 71.23 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.337 -0.847 . . . . 54.41 111.935 175.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.55 -54.44 37.09 Favored Glycine 0 N--CA 1.48 1.633 0 CA-C-O 121.064 0.258 . . . . 73.1 113.274 176.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 48.3 tp -64.96 -34.66 78.94 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.718 0.407 . . . . 74.52 111.539 175.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.488 HG21 HD11 ' A' ' 107' ' ' ILE . 59.5 m -56.17 -44.79 79.68 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.086 0.554 . . . . 73.05 110.672 173.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.54 -36.58 73.76 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.117 0.567 . . . . 72.04 112.173 178.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.555 HD11 ' HG3' ' B' ' 36' ' ' GLN . 84.8 mt -59.88 -45.09 93.61 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.452 0.644 . . . . 60.3 111.618 173.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.468 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 90.3 mt -76.18 -30.34 58.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.763 0.825 . . . . 74.35 111.496 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.4 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -67.03 -41.97 85.69 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.793 0.837 . . . . 74.41 110.706 176.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.9 t -72.54 -38.09 68.1 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 122.262 -0.273 . . . . 70.51 111.358 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -56.48 -42.16 77.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.107 0.563 . . . . 73.43 112.368 178.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.452 HG13 ' O ' ' B' ' 119' ' ' LEU . 14.2 m -64.24 -26.0 39.36 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 111.92 0.341 . . . . 73.42 111.92 176.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 60.7 mtm -78.45 -39.67 37.89 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 109.48 -0.563 . . . . 65.32 109.48 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.415 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 41.4 mtpt -61.8 -36.37 80.92 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.639 0.775 . . . . 73.04 111.398 174.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.618 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 13.9 mt -76.49 -41.04 48.51 Favored 'General case' 0 C--O 1.216 -0.687 0 C-N-CA 123.981 0.912 . . . . 53.42 111.494 178.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.29 -32.72 73.49 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 121.42 0.628 . . . . 62.14 111.01 173.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.92 -39.46 61.39 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.006 0.922 . . . . 74.31 110.021 176.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.482 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 58.2 tptt -62.12 -43.1 99.58 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.339 1.056 . . . . 42.42 111.17 176.483 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.471 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.1 t -61.3 -48.53 88.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 C-N-CA 124.173 0.989 . . . . 72.34 110.52 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.5 pt20 -69.45 -28.8 66.42 Favored 'General case' 0 CA--C 1.551 0.989 0 CA-C-N 116.505 -0.316 . . . . 70.51 111.11 179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 23.1 t70 -66.21 -36.59 83.44 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 123.096 0.558 . . . . 72.22 110.621 175.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.526 HD11 HG13 ' A' ' 130' ' ' VAL . 19.1 mt -76.93 -45.94 26.0 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 116.296 -0.411 . . . . 71.32 110.55 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.6 t -67.35 -23.97 65.66 Favored 'General case' 0 N--CA 1.485 1.305 0 N-CA-C 111.923 0.342 . . . . 62.33 111.923 178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.14 -45.4 81.16 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 122.846 0.458 . . . . 74.32 111.043 172.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.557 ' HB2' HD11 ' A' ' 137' ' ' LEU . 44.6 mt -79.33 -21.37 45.98 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.644 0.778 . . . . 71.32 111.852 178.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.402 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.9 OUTLIER -74.62 -52.24 12.27 Favored 'General case' 0 CA--C 1.552 1.057 0 N-CA-C 108.331 -0.989 . . . . 72.41 108.331 176.962 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.5 -27.72 67.82 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 124.553 1.141 . . . . 74.12 112.967 177.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.7 t -145.79 103.07 3.74 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.429 0.692 . . . . 70.11 110.166 179.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -85.65 161.74 19.11 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.329 0.651 . . . . 71.24 111.784 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -64.29 -33.49 75.94 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.866 0.867 . . . . 51.42 111.52 179.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 34.9 t70 . . . . . 0 CA--C 1.57 1.744 0 C-N-CA 123.999 0.92 . . . . 72.2 110.46 174.671 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 CA-C-O 120.498 -0.057 . . . . 74.14 112.989 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.401 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 77.8 p -114.42 48.41 1.12 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.585 0.754 . . . . 73.52 110.768 177.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -73.21 -44.78 59.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 124.128 0.971 . . . . 72.41 111.463 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -70.39 -32.64 70.37 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 123.027 0.531 . . . . 63.31 111.082 175.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 2' ' ' SER . 38.1 mm-40 -69.9 146.49 51.19 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 123.003 0.521 . . . . 54.42 110.493 168.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -71.34 -17.32 62.44 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.898 0.479 . . . . 72.04 111.651 171.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.588 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 14.5 t70 64.14 43.63 4.91 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.777 1.231 . . . . 73.33 110.401 -177.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.01 -14.64 58.4 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 114.843 -1.072 . . . . 74.54 112.102 176.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -60.92 -22.51 64.43 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 113.097 0.777 . . . . 64.43 113.097 -177.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.3 p -66.49 -25.69 66.82 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 112.622 0.601 . . . . 71.05 112.622 173.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m95 -52.45 -23.6 6.43 Favored 'General case' 0 N--CA 1.503 2.22 0 N-CA-C 113.569 0.951 . . . . 75.1 113.569 170.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.3 t -58.52 -25.62 62.61 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 123.333 0.653 . . . . 63.21 112.478 177.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 58.3 t -63.93 -38.51 82.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 C-N-CA 123.707 0.803 . . . . 74.31 111.214 172.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 59.0 mt -81.63 -31.54 32.35 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.325 0.65 . . . . 72.25 112.101 179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -47.19 -55.9 7.66 Favored 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.865 1.266 . . . . 72.43 114.32 -169.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.04 -19.52 59.17 Favored Glycine 0 CA--C 1.538 1.469 0 N-CA-C 114.489 0.556 . . . . 74.12 114.489 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.475 ' HB2' HG12 ' A' ' 94' ' ' VAL . 63.6 m-85 -105.03 -2.88 23.87 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.637 0.775 . . . . 71.22 112.022 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -63.41 -26.64 68.83 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.494 0.553 . . . . 61.45 112.494 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.9 p -58.83 -36.22 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 120.981 0.42 . . . . 64.01 111.485 173.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.4 m -79.35 -42.84 24.72 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.218 1.007 . . . . 51.5 110.711 176.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.504 HD23 HD12 ' A' ' 90' ' ' LEU . 96.1 mt -57.17 -45.01 84.04 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.66 0.784 . . . . 63.34 111.549 178.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.486 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -72.7 -18.38 61.54 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.482 0.713 . . . . 74.21 112.822 -179.656 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 65.2 m -82.57 -38.25 23.94 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 112.492 0.553 . . . . 71.13 112.492 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.44 HG11 HD21 ' A' ' 90' ' ' LEU . 72.0 t -89.03 -54.33 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 N-CA-C 113.822 1.045 . . . . 73.13 113.822 -174.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.464 HD11 HD22 ' A' ' 21' ' ' LEU . 59.3 mt -70.8 145.24 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 N-CA-C 113.435 0.902 . . . . 73.41 113.435 -165.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -100.47 111.96 63.59 Favored Pre-proline 0 C--O 1.253 1.241 0 N-CA-C 109.399 -0.593 . . . . 72.35 109.399 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.604 ' HG2' ' HG2' ' A' ' 60' ' ' LYS . 36.2 Cg_exo -56.28 -24.3 50.36 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.488 2.125 . . . . 65.41 111.746 176.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.6 p -70.46 -38.8 74.52 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.899 1.279 . . . . 62.52 112.101 -179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -81.28 -28.13 34.82 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 117.932 0.333 . . . . 75.22 111.166 -172.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.2 pt -88.23 -6.98 10.87 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.304 0 C-N-CA 123.277 0.631 . . . . 72.12 112.424 -179.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' O ' ' A' ' 27' ' ' PRO . 66.0 p -53.72 -48.49 93.16 Favored Pre-proline 0 N--CA 1.497 1.889 0 CA-C-O 117.324 -1.322 . . . . 51.3 113.956 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_exo -65.94 -37.35 27.04 Favored 'Trans proline' 0 C--N 1.399 3.219 0 CA-C-N 122.012 1.754 . . . . 64.4 112.318 -175.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.7 t80 -64.02 -52.49 59.25 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 115.734 -0.666 . . . . 71.14 109.933 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.8 mt -65.75 -29.55 70.08 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.961 0.726 . . . . 74.13 112.961 -178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm180 -55.95 -55.17 35.89 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.742 0.817 . . . . 64.22 110.698 169.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -72.28 -21.24 61.39 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 115.112 -0.949 . . . . 72.24 112.225 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 89.1 m -76.72 -6.19 51.16 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.287 0.635 . . . . 74.01 111.745 170.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.99 20.28 4.43 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.493 1.117 . . . . 73.31 112.224 168.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.3 m -108.38 -34.93 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 123.486 0.714 . . . . 63.51 112.032 178.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.758 HD21 ' HB3' ' A' ' 45' ' ' GLU . 8.9 tt -97.87 129.26 44.83 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.896 0.879 . . . . 75.12 108.719 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -105.86 158.71 31.79 Favored Pre-proline 0 CA--C 1.559 1.315 0 C-N-CA 124.44 1.096 . . . . 72.34 110.61 -177.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -64.04 -16.08 52.86 Favored 'Trans proline' 0 C--N 1.381 2.272 0 C-N-CA 122.586 2.19 . . . . 54.23 115.29 -174.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -86.57 -43.4 12.72 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-N 118.617 0.644 . . . . 73.22 112.092 178.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.62 ' HB2' HD13 ' A' ' 67' ' ' ILE . 1.9 p30 -67.85 -44.47 77.09 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 111.982 0.364 . . . . 74.43 111.982 -173.519 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.758 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.0 pt-20 -48.49 -32.89 8.52 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.504 0.927 . . . . 71.35 113.504 168.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -78.42 -43.35 27.57 Favored 'General case' 0 N--CA 1.484 1.264 0 O-C-N 121.705 -0.622 . . . . 70.5 111.66 179.11 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.608 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.4 pt20 -71.73 -34.77 69.82 Favored 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 111.942 0.349 . . . . 74.1 111.942 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.462 HG22 HG23 ' A' ' 63' ' ' VAL . 52.4 t -65.17 -55.42 20.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.028 0.931 . . . . 74.12 110.641 175.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -78.73 74.28 5.26 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 122.193 0.997 . . . . 71.54 111.528 178.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.8 t -94.15 2.55 55.95 Favored 'General case' 0 CA--C 1.555 1.135 0 CA-C-N 114.443 -1.253 . . . . 53.0 109.12 166.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.415 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 5.8 t0 -150.73 122.31 3.95 Favored Pre-proline 0 CA--C 1.559 1.311 0 C-N-CA 125.326 1.45 . . . . 73.24 109.282 -174.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -86.56 -19.2 2.92 Favored 'Trans proline' 0 CA--C 1.565 2.032 0 C-N-CA 122.623 2.216 . . . . 74.43 113.523 172.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -99.35 -155.5 0.51 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.262 1.025 . . . . 71.45 111.211 -176.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.637 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -97.96 27.49 4.48 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.663 0.785 . . . . 73.21 113.043 175.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.2 t -69.41 -57.64 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.849 -0.532 . . . . 63.23 111.356 -174.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -117.9 23.43 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 123.233 0.613 . . . . 71.23 111.007 173.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.655 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 58.1 ttm-85 -49.64 -36.68 25.39 Favored 'General case' 0 N--CA 1.49 1.565 0 N-CA-C 113.945 1.091 . . . . 71.4 113.945 -175.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -58.37 -49.45 77.2 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.578 0.751 . . . . 65.41 111.774 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 19.8 ptp180 -81.02 -26.29 36.53 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 122.052 -0.405 . . . . 74.31 111.445 176.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.655 ' HE2' ' HA ' ' A' ' 57' ' ' ARG . 38.8 ttpt -66.29 -49.32 67.48 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.376 1.07 . . . . 55.22 112.244 -174.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.486 ' HB ' HG22 ' A' ' 22' ' ' THR . 37.2 t -67.56 -38.36 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.623 -0.51 . . . . 52.03 109.623 174.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.88 -38.01 95.85 Favored Glycine 0 C--N 1.354 1.542 0 N-CA-C 114.562 0.585 . . . . 34.04 114.562 -177.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.462 HG23 HG22 ' A' ' 48' ' ' VAL . 30.7 m -71.99 -34.39 50.53 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 117.178 0.489 . . . . 73.12 110.98 177.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.444 ' O ' ' HG ' ' A' ' 68' ' ' LEU . 45.7 tp -64.86 -42.14 95.12 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 117.866 0.303 . . . . 75.04 110.634 172.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 97.2 mt -59.16 -33.9 71.47 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.384 0.674 . . . . 74.53 111.481 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.34 -42.77 92.55 Favored 'General case' 0 CA--C 1.564 1.502 0 C-N-CA 124.232 1.013 . . . . 72.51 111.58 171.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.62 HD13 ' HB2' ' A' ' 44' ' ' ASP . 73.0 mt -70.27 -27.54 32.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 123.595 0.758 . . . . 74.32 111.49 178.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.466 HD13 ' HB2' ' A' ' 79' ' ' PHE . 75.4 mt -81.74 -31.65 31.89 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 123.128 0.571 . . . . 74.43 110.054 173.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 22.8 tm0? -68.2 -38.48 82.0 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.598 0.759 . . . . 74.21 111.494 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -67.94 -16.46 64.07 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 112.65 0.611 . . . . 71.25 112.65 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 60.1 p -80.63 -46.68 15.25 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.336 -0.987 . . . . 34.32 108.336 170.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 120.97 -116.66 3.24 Favored Glycine 0 C--N 1.352 1.47 0 CA-C-N 115.189 -0.914 . . . . 74.52 112.434 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.588 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 72.7 t60 -69.77 -30.19 67.7 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.45 1.1 . . . . 75.22 110.292 176.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.2 mmmm -54.97 -64.7 0.75 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.17 0.988 . . . . 73.31 111.824 173.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 68' ' ' LEU . . . -62.66 -31.57 80.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-O 120.216 -0.213 . . . . 61.24 112.897 -178.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 53.4 t80 -54.58 -66.2 0.44 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 123.722 0.809 . . . . 63.03 112.215 170.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' HD12 ' A' ' 80' ' ' LEU . 59.2 t -63.95 -35.43 73.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 C-N-CA 123.674 0.79 . . . . 52.11 111.819 -176.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.06 -48.98 79.46 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.778 -0.646 . . . . 75.13 111.335 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.466 ' HB2' HD13 ' A' ' 68' ' ' LEU . 68.3 t80 -64.06 -39.82 94.92 Favored 'General case' 0 C--N 1.353 0.739 0 CA-C-N 116.213 -0.449 . . . . 72.43 110.982 176.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 80.7 mt -56.11 -54.35 46.14 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 123.303 0.641 . . . . 61.01 112.543 176.522 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -80.12 -23.53 41.13 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 113.238 0.829 . . . . 72.11 113.238 -173.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 90.8 p -67.47 -47.12 71.01 Favored 'General case' 0 N--CA 1.482 1.137 0 N-CA-C 109.254 -0.646 . . . . 71.42 109.254 164.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -64.55 -29.59 70.61 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.223 0.609 . . . . 75.23 111.707 179.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.09 -45.37 95.0 Favored 'General case' 0 N--CA 1.482 1.152 0 N-CA-C 109.009 -0.738 . . . . 74.2 109.009 175.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.4 tt -69.77 -55.86 8.72 Favored 'General case' 0 CA--C 1.561 1.381 0 C-N-CA 123.7 0.8 . . . . 73.32 111.096 178.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -77.89 -46.41 21.42 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.841 1.052 . . . . 74.13 113.841 -170.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.404 ' HB3' HD23 ' A' ' 90' ' ' LEU . 94.4 m-85 -137.71 75.44 43.49 Favored Pre-proline 0 N--CA 1.501 2.085 0 CA-C-N 118.588 0.631 . . . . 71.13 110.882 178.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -65.74 -20.36 59.13 Favored 'Trans proline' 0 C--N 1.374 1.911 0 C-N-CA 122.752 2.301 . . . . 73.31 113.589 -174.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -74.41 -40.68 61.85 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.496 0.719 . . . . 71.11 111.325 174.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.504 HD12 HD23 ' A' ' 21' ' ' LEU . 4.3 mm? -64.28 -37.2 86.65 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.2 0.6 . . . . 71.42 110.329 171.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 48.5 t80 -64.3 -47.57 78.98 Favored 'General case' 0 CA--C 1.555 1.141 0 CA-C-N 116.092 -0.504 . . . . 73.1 110.948 174.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -58.34 -42.37 86.71 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.588 0.755 . . . . 71.32 112.254 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -70.75 -45.69 64.33 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 112.575 0.583 . . . . 75.32 112.575 178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.475 HG12 ' HB2' ' A' ' 17' ' ' PHE . 29.1 m -63.37 -37.27 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 112.761 0.652 . . . . 74.02 112.761 -179.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.498 ' HB ' ' HD2' ' A' ' 97' ' ' LYS . 68.5 p -88.01 -33.67 18.29 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 112.182 0.438 . . . . 62.14 112.182 -177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 73.62 11.09 80.4 Favored Glycine 0 N--CA 1.479 1.503 0 CA-C-N 115.817 -0.629 . . . . 42.33 114.043 -178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.498 ' HD2' ' HB ' ' A' ' 95' ' ' THR . 0.0 OUTLIER -140.38 165.25 27.93 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.165 0.986 . . . . 71.11 110.742 -178.215 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -60.61 130.38 90.27 Favored Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 123.484 0.714 . . . . 74.21 111.624 179.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.12 120.66 5.8 Favored 'Trans proline' 0 C--N 1.376 2.017 0 C-N-CA 123.104 2.536 . . . . 62.32 113.559 176.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -80.4 -20.5 43.85 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.198 0.599 . . . . 62.45 110.821 -178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.457 ' NH2' ' SD ' ' B' ' 120' ' ' MET . 66.8 mtp180 59.54 53.35 5.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.08 1.352 . . . . 71.13 110.617 175.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.2 t -76.94 50.61 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.6 0 C-N-CA 125.761 1.624 . . . . 74.43 112.023 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -59.87 -4.69 0.77 Allowed 'General case' 0 CA--C 1.563 1.478 0 C-N-CA 123.811 0.844 . . . . 74.41 113.007 176.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.532 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.9 t -61.98 -21.7 65.06 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.539 0.735 . . . . 62.55 110.734 172.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 tpt -53.62 -62.14 1.85 Allowed 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.228 1.011 . . . . 63.44 111.32 172.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.463 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -75.23 -25.97 18.49 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.521 0 C-N-CA 123.291 0.636 . . . . 63.32 110.56 -178.852 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.536 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.4 mp -64.16 -41.16 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 122.995 0.518 . . . . 74.15 111.791 173.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -80.5 -31.63 37.15 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.583 -0.698 . . . . 70.11 111.949 174.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.41 -62.01 1.58 Allowed 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.082 0.553 . . . . 75.42 112.208 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 42.9 t -103.75 -42.83 5.51 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.275 0.63 . . . . 33.21 112.243 178.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 131.4 167.2 11.86 Favored Glycine 0 N--CA 1.473 1.16 0 CA-C-N 116.444 -0.344 . . . . 70.43 112.452 -172.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.8 mp0 -64.35 -41.95 96.49 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.052 0.541 . . . . 75.44 110.333 177.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 81.2 p -65.4 -28.39 69.22 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.186 0.994 . . . . 73.22 111.723 176.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.7 -56.61 23.93 Favored Glycine 0 C--N 1.351 1.412 0 CA-C-N 116.523 -0.308 . . . . 62.22 112.443 171.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.463 ' HB2' HD12 ' A' ' 106' ' ' ILE . 29.8 tp -64.47 -30.74 71.77 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.872 0.469 . . . . 73.44 111.586 175.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 46.4 m -58.65 -48.46 80.98 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.324 0.65 . . . . 73.24 110.681 174.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -68.08 -39.26 82.96 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.669 0.388 . . . . 74.11 111.861 177.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 72.6 mt -55.86 -48.72 75.02 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 123.121 0.568 . . . . 61.11 111.806 175.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.3 mt -69.48 -40.43 77.08 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.827 0.851 . . . . 61.44 111.215 178.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.44 -40.03 77.54 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.804 0.841 . . . . 72.11 111.962 178.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.8 t -79.83 -36.73 36.42 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.593 0.59 . . . . 70.43 112.593 172.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -62.94 -34.71 78.04 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.013 0.525 . . . . 72.15 112.309 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 119' ' ' LEU . 33.1 m -65.98 -24.56 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.096 0 CA-C-O 119.612 -0.233 . . . . 74.53 111.158 175.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 30.0 mtm -82.02 -31.15 31.15 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.134 0.574 . . . . 64.33 110.88 177.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.3 mmpt? -62.0 -53.6 53.33 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-O 121.8 0.809 . . . . 73.22 109.874 172.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.1 mt -59.69 -38.87 82.72 Favored 'General case' 0 CA--C 1.549 0.92 0 CA-C-N 114.47 -1.241 . . . . 73.25 112.703 172.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -63.83 -36.95 85.58 Favored 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 122.949 0.5 . . . . 73.23 111.208 176.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -66.15 -45.27 81.6 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.255 1.022 . . . . 44.41 110.468 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.523 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 51.5 tptt -61.17 -46.53 90.12 Favored 'General case' 0 CA--C 1.554 1.113 0 CA-C-N 115.343 -0.844 . . . . 73.31 110.919 178.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 126' ' ' LEU . 46.1 t -57.6 -53.95 37.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 124.315 1.046 . . . . 62.11 111.667 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.466 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.7 pt20 -64.64 -31.48 72.72 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.726 0.41 . . . . 73.41 111.324 -176.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.8 t70 -64.94 -53.63 43.32 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 122.711 0.404 . . . . 54.32 110.124 174.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.8 mt -65.7 -31.15 71.99 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.992 0.517 . . . . 75.35 112.086 -175.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.466 HG22 ' HA ' ' A' ' 131' ' ' GLN . 2.9 t -77.09 -31.18 55.78 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.245 0.218 . . . . 74.54 111.159 176.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.96 -36.81 84.35 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.364 0.665 . . . . 42.54 111.775 172.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 55.7 mt -74.94 -40.65 60.68 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.467 0.707 . . . . 63.34 110.889 176.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.675 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -61.35 -39.0 88.97 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.51 1.124 . . . . 45.45 110.936 173.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 26.7 t -57.04 -42.82 81.18 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.21 1.004 . . . . 61.13 111.98 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -147.08 104.56 3.69 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.716 0.806 . . . . 74.34 109.388 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -78.53 163.29 25.67 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.409 0.684 . . . . 71.41 111.296 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.77 -40.13 40.29 Favored 'General case' 0 CA--C 1.56 1.358 0 C-N-CA 123.976 0.91 . . . . 62.43 112.353 171.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 CA--C 1.565 1.53 0 C-N-CA 124.04 0.936 . . . . 73.44 110.881 174.685 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.174 0 N-CA-C 113.683 0.233 . . . . 64.41 113.683 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 85.6 p -141.76 -175.35 4.35 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.229 1.012 . . . . 74.14 111.434 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 59.59 -86.8 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 124.932 1.293 . . . . 72.11 112.632 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -76.31 -26.87 56.28 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.865 0.866 . . . . 75.11 110.781 179.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -83.24 87.47 6.94 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.688 0.795 . . . . 72.3 110.267 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -84.54 66.2 9.38 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 115.5 -0.773 . . . . 64.42 109.628 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -95.32 130.18 42.19 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.655 0.74 . . . . 63.54 112.56 -169.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -80.38 -13.34 59.24 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.788 0.835 . . . . 72.04 111.11 169.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -60.9 -38.74 86.73 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.067 0.947 . . . . 73.53 113.283 -174.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 7.3 p -63.39 -27.05 69.04 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 113.34 0.867 . . . . 72.12 113.34 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -53.53 -20.14 4.59 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 113.997 1.11 . . . . 73.23 113.997 170.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 34.1 t -63.02 -31.53 72.69 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.302 0.641 . . . . 63.52 112.403 176.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -59.27 -36.89 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 C-N-CA 123.84 0.856 . . . . 75.23 110.869 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 66.0 mt -85.34 -33.65 22.0 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.647 0.779 . . . . 75.22 111.519 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.552 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.9 tt0 -58.37 -44.95 89.07 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 124.227 1.011 . . . . 75.44 112.203 -176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.06 -13.38 14.24 Favored Glycine 0 CA--C 1.54 1.609 0 N-CA-C 115.171 0.828 . . . . 65.25 115.171 175.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -120.7 14.81 11.8 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.599 0.76 . . . . 74.53 112.411 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 16.5 mtp180 -49.53 -50.34 42.29 Favored 'General case' 0 N--CA 1.502 2.151 0 N-CA-C 112.907 0.706 . . . . 61.41 112.907 -179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.9 p -59.48 -29.78 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 C-N-CA 123.255 0.622 . . . . 75.42 112.441 -178.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 55.5 m -80.45 -47.85 13.73 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.287 0.635 . . . . 50.45 111.243 176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.571 HD23 HD12 ' B' ' 90' ' ' LEU . 82.9 mt -57.05 -39.88 75.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.033 0.933 . . . . 75.42 110.964 -179.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.502 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 68.7 p -72.87 -26.33 61.41 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 113.357 0.873 . . . . 74.33 113.357 -179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 70.0 m -82.8 -35.62 26.29 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.071 0.548 . . . . 62.53 112.101 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.75 HG11 HD21 ' B' ' 90' ' ' LEU . 49.1 t -91.45 -49.83 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 113.464 0.913 . . . . 51.11 113.464 -173.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 65.8 mt -76.69 149.08 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 N-CA-C 112.982 0.734 . . . . 71.23 112.982 -170.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.414 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 10.4 m-20 -112.07 109.45 54.62 Favored Pre-proline 0 C--O 1.249 1.026 0 C-N-CA 123.855 0.862 . . . . 71.51 108.901 170.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.733 ' HD3' HG22 ' B' ' 61' ' ' VAL . 51.0 Cg_endo -64.45 -15.5 50.12 Favored 'Trans proline' 0 C--N 1.378 2.096 0 C-N-CA 122.409 2.073 . . . . 75.24 111.763 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 60.3 p -70.08 -36.52 74.98 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 123.781 0.832 . . . . 60.45 111.357 178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 12.3 ptm180 -85.89 -26.67 25.48 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 111.754 0.279 . . . . 72.33 111.754 -173.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.9 pt -90.71 -20.4 6.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 N-CA-C 112.58 0.585 . . . . 71.22 112.58 -176.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.445 HG23 ' O ' ' B' ' 27' ' ' PRO . 4.5 p -61.05 -42.69 87.8 Favored Pre-proline 0 CA--C 1.573 1.864 0 N-CA-C 114.63 1.344 . . . . 74.42 114.63 -179.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_exo -55.47 -35.76 92.82 Favored 'Trans proline' 0 C--N 1.399 3.207 0 C-N-CA 122.315 2.01 . . . . 72.33 113.355 173.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -70.18 -49.71 47.56 Favored 'General case' 0 CA--C 1.561 1.401 0 C-N-CA 123.998 0.919 . . . . 74.21 111.307 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 95.6 mt -58.93 -24.25 62.24 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 124.319 1.048 . . . . 71.5 113.241 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.568 ' HD3' HD22 ' B' ' 40' ' ' LEU . 19.1 mmt85 -50.83 -61.33 2.28 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.121 0.962 . . . . 61.54 111.085 171.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.5 mm100 -73.52 -17.98 61.15 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.757 -1.565 . . . . 70.3 111.511 -174.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 58.8 m -71.93 -11.52 60.82 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.276 0.63 . . . . 60.21 111.474 171.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 62.27 36.98 14.39 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 124.981 1.312 . . . . 61.23 112.651 172.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.496 HG12 ' HB3' ' B' ' 74' ' ' LYS . 27.7 m -117.9 -33.58 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 C-N-CA 123.729 0.811 . . . . 74.21 110.307 173.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.598 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.4 tt -82.3 121.36 26.58 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.105 -0.952 . . . . 71.24 110.169 -178.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -92.72 153.8 42.25 Favored Pre-proline 0 CA--C 1.555 1.169 0 C-N-CA 124.002 0.921 . . . . 70.21 110.72 174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 79.7 Cg_exo -47.61 -34.19 19.94 Favored 'Trans proline' 0 C--N 1.385 2.493 0 C-N-CA 123.772 2.981 . . . . 51.55 114.112 175.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -64.83 -47.89 76.33 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 124.154 0.982 . . . . 75.15 111.894 177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -57.72 -62.82 1.52 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.467 1.107 . . . . 54.02 111.219 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.598 ' HB3' HD21 ' B' ' 40' ' ' LEU . 13.4 pt-20 -46.24 -36.9 6.56 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 113.847 1.055 . . . . 70.22 113.847 175.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -72.54 -49.05 35.33 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.241 0.616 . . . . 73.52 112.131 -178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -75.52 -32.13 60.37 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 111.975 0.361 . . . . 75.33 111.975 -177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 79.2 t -68.28 -55.64 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.29 0.636 . . . . 70.14 109.995 172.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -85.68 54.86 3.27 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-O 122.163 0.982 . . . . 70.42 111.177 174.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 47.8 t -71.55 -30.03 65.42 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 114.549 -1.205 . . . . 73.21 108.84 163.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -108.11 119.84 48.68 Favored Pre-proline 0 CA--C 1.558 1.263 0 C-N-CA 125.013 1.325 . . . . 71.51 109.631 166.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -75.01 -30.63 6.94 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.337 2.025 . . . . 74.43 113.082 172.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.52 ' HB2' HG23 ' B' ' 55' ' ' VAL . 13.0 m120 -76.93 -167.48 0.87 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.034 0.933 . . . . 61.14 112.378 -174.486 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.543 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.4 pt? -97.71 19.41 13.68 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.799 -0.563 . . . . 71.35 111.954 172.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.52 HG23 ' HB2' ' B' ' 53' ' ' ASN . 98.2 t -60.88 -57.82 10.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.353 0.661 . . . . 75.11 112.073 -174.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.537 HG13 ' HB2' ' B' ' 60' ' ' LYS . 48.7 pt -104.67 23.8 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 112.273 0.472 . . . . 64.42 112.273 -179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 25.4 ttt180 -39.13 -42.57 0.95 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 125.788 1.635 . . . . 63.2 114.664 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.415 ' O ' ' HB ' ' B' ' 22' ' ' THR . 4.2 tppp? -59.1 -61.18 2.83 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.548 0.739 . . . . 72.25 111.597 178.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -72.7 -20.12 61.28 Favored 'General case' 0 N--CA 1.482 1.165 0 O-C-N 121.878 -0.514 . . . . 50.24 112.329 -179.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.537 ' HB2' HG13 ' B' ' 56' ' ' ILE . 37.2 ttpt -79.3 -36.49 39.54 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 112.79 0.663 . . . . 73.44 112.79 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.733 HG22 ' HD3' ' B' ' 27' ' ' PRO . 27.0 t -70.01 -34.94 61.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 109.012 -0.736 . . . . 64.31 109.012 169.12 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.21 -45.7 95.98 Favored Glycine 0 C--N 1.354 1.54 0 CA-C-N 115.542 -0.754 . . . . 73.31 113.484 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 32.7 m -67.25 -34.48 69.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 CA-C-N 116.942 0.371 . . . . 74.11 110.624 178.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 57.7 tp -58.47 -49.51 77.06 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.034 0.534 . . . . 71.32 111.875 173.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' B' ' 69' ' ' GLN . 80.6 mt -58.13 -50.92 71.81 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 123.286 0.634 . . . . 54.2 110.771 178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -53.21 -41.46 65.37 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.959 1.303 . . . . 72.41 112.231 177.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.2 mt -75.78 -41.25 40.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 C-N-CA 123.223 0.609 . . . . 64.02 111.505 179.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.0 mt -64.35 -20.3 66.02 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 123.378 0.671 . . . . 60.31 112.018 178.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.436 ' HG2' ' O ' ' B' ' 65' ' ' LEU . 82.4 mm-40 -52.74 -26.74 15.02 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 113.171 0.804 . . . . 73.42 113.171 166.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -59.1 -29.32 67.27 Favored 'General case' 0 N--CA 1.502 2.139 0 C-N-CA 123.492 0.717 . . . . 74.51 112.098 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.471 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 60.0 p -96.8 -1.51 46.06 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.704 0.802 . . . . 74.33 112.13 -178.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 57.17 -120.89 23.18 Favored Glycine 0 C--N 1.354 1.581 0 N-CA-C 115.324 0.89 . . . . 31.24 115.324 -177.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -61.74 -32.6 72.85 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.257 1.023 . . . . 73.1 111.799 -178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.496 ' HB3' HG12 ' B' ' 39' ' ' VAL . 10.8 mmmm -55.25 -52.34 63.72 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.905 0.882 . . . . 60.23 111.685 176.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.88 -39.42 97.49 Favored Glycine 0 C--N 1.348 1.237 0 O-C-N 123.698 0.624 . . . . 75.03 113.553 178.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -55.25 -59.57 4.6 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.279 0.631 . . . . 73.04 111.813 173.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 66.0 t -61.24 -38.21 79.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.105 0.562 . . . . 54.22 111.344 -177.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.65 -32.38 69.66 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 112.352 0.501 . . . . 73.2 112.352 178.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -66.92 -43.0 84.44 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 110.168 -0.308 . . . . 74.22 110.168 174.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.3 -49.21 76.53 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.751 0.31 . . . . 64.53 110.726 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -45.23 -52.33 9.64 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 126.263 1.825 . . . . 75.12 112.326 175.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 81.0 p -69.2 -45.2 70.51 Favored 'General case' 0 N--CA 1.482 1.137 0 CA-C-N 116.387 -0.369 . . . . 61.32 111.804 174.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.7 tp -63.51 -43.8 96.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.518 0.727 . . . . 62.3 112.85 -169.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -21.89 61.74 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.428 1.091 . . . . 71.33 112.033 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.401 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 10.2 tt -90.0 -58.34 2.54 Favored 'General case' 0 CA--C 1.558 1.255 0 C-N-CA 123.908 0.883 . . . . 71.22 110.888 173.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -75.51 -51.97 11.73 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.518 0.727 . . . . 73.25 112.906 -170.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.662 ' HB3' HD23 ' B' ' 90' ' ' LEU . 97.0 m-85 -130.14 75.38 79.42 Favored Pre-proline 0 N--CA 1.487 1.397 0 C-N-CA 123.165 0.586 . . . . 64.1 110.186 -179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.35 -36.32 67.8 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 123.514 2.809 . . . . 74.21 113.763 -174.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 14.6 pt20 -59.9 -31.23 69.62 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.986 0.914 . . . . 71.13 112.282 173.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.75 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -71.48 -35.84 70.94 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 122.547 0.339 . . . . 52.22 110.717 177.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.504 ' HA ' HG22 ' B' ' 94' ' ' VAL . 79.5 t80 -65.84 -45.54 81.85 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-O 120.659 0.266 . . . . 74.4 110.39 171.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -51.06 -44.26 61.13 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 124.118 0.967 . . . . 72.55 111.866 175.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 17.5 ptpt -76.53 -42.08 44.42 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.181 0.808 . . . . 65.4 113.181 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.526 HG23 HG23 ' B' ' 95' ' ' THR . 25.7 m -62.3 -38.62 81.58 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 CA-C-N 119.555 1.07 . . . . 54.4 112.901 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.526 HG23 HG23 ' B' ' 94' ' ' VAL . 67.8 p -97.16 -41.27 8.4 Favored 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 112.145 0.424 . . . . 55.34 112.145 -177.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 111.52 -11.37 28.19 Favored Glycine 0 N--CA 1.477 1.411 0 CA-C-O 120.099 -0.278 . . . . 15.41 113.704 -176.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.03 166.34 22.64 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.533 0.666 . . . . 73.23 111.693 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.9 154.26 19.54 Favored Pre-proline 0 N--CA 1.488 1.445 0 C-N-CA 124.642 1.177 . . . . 72.23 112.59 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -46.55 128.73 13.06 Favored 'Trans proline' 0 C--N 1.384 2.439 0 C-N-CA 123.399 2.732 . . . . 64.31 114.934 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.36 -26.43 55.67 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 115.61 -0.723 . . . . 42.12 109.847 174.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 31.3 ttp180 68.05 56.42 0.53 Allowed 'General case' 0 CA--C 1.552 1.028 0 C-N-CA 125.43 1.492 . . . . 72.11 109.281 -179.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.1 t -70.99 45.79 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.782 0 C-N-CA 125.221 1.408 . . . . 70.14 112.689 -179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.541 ' O ' HG12 ' B' ' 107' ' ' ILE . 2.7 m-30 -71.2 -8.45 53.65 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 123.783 0.833 . . . . 71.32 111.547 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 51.8 p -59.3 -28.03 66.41 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.252 1.021 . . . . 75.01 111.715 171.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 11.9 tpt -57.75 -57.57 12.16 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.879 0.872 . . . . 74.23 110.862 174.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.474 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -71.01 -27.37 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.494 0 C-N-CA 123.115 0.566 . . . . 62.44 110.847 179.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.541 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.5 mm -60.4 -48.0 90.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 122.059 -0.401 . . . . 65.34 111.219 172.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -74.36 -29.77 61.71 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 112.693 0.627 . . . . 64.34 112.693 175.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.474 ' HB3' ' HA ' ' B' ' 106' ' ' ILE . . . -72.33 -57.09 4.49 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 112.983 0.735 . . . . 65.31 112.983 -176.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -121.1 3.21 10.44 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 123.842 0.857 . . . . 72.41 112.549 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.87 165.53 41.4 Favored Glycine 0 CA--C 1.534 1.242 0 O-C-N 122.353 -0.217 . . . . 30.43 113.168 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.427 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -63.06 -36.67 84.34 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.447 0.699 . . . . 51.55 110.574 176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 87.4 p -64.45 -31.16 72.26 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.16 0.984 . . . . 54.41 111.941 177.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -63.61 -53.56 37.67 Favored Glycine 0 C--N 1.354 1.537 0 CA-C-O 121.072 0.262 . . . . 73.1 112.795 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.436 HD21 ' HD2' ' B' ' 103' ' ' PHE . 28.0 tp -62.09 -35.84 79.87 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.297 0.639 . . . . 74.52 111.584 175.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.535 ' O ' ' HB2' ' B' ' 120' ' ' MET . 91.7 m -58.21 -48.68 79.6 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 122.948 0.499 . . . . 73.05 109.807 173.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -60.22 -45.61 92.62 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.286 0.634 . . . . 72.04 111.655 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 97.3 mt -55.57 -57.62 11.2 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 123.76 0.824 . . . . 60.3 112.314 177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 78.1 mt -61.52 -52.69 63.44 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.417 -0.811 . . . . 74.35 111.415 179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.535 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -48.09 -51.57 23.98 Favored 'General case' 0 N--CA 1.499 2.012 0 C-N-CA 125.344 1.458 . . . . 74.41 112.71 178.135 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.2 t -69.37 -37.0 77.38 Favored 'General case' 0 N--CA 1.48 1.053 0 O-C-N 122.084 -0.385 . . . . 70.51 111.654 177.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -69.61 -21.81 63.54 Favored 'General case' 0 CA--C 1.554 1.099 0 N-CA-C 112.697 0.628 . . . . 73.43 112.697 -178.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.535 HG22 ' O ' ' B' ' 120' ' ' MET . 3.6 m -67.13 -23.77 31.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 CA-C-N 118.613 0.642 . . . . 73.42 110.236 173.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 45.7 mtm -79.1 -36.44 40.71 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 123.085 0.554 . . . . 65.32 109.811 177.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.546 ' HE2' ' HA ' ' B' ' 125' ' ' LYS . 10.9 mmpt? -62.19 -41.19 98.12 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.733 0.813 . . . . 73.04 111.501 172.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.624 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 17.4 mt -70.17 -40.6 74.6 Favored 'General case' 0 C--O 1.216 -0.677 0 C-N-CA 124.289 1.036 . . . . 53.42 111.056 176.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -63.57 -37.41 87.22 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.348 0.659 . . . . 62.14 111.488 176.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -70.53 -41.63 72.27 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 108.6 -0.889 . . . . 74.31 108.6 176.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.539 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 57.6 tptt -59.61 -45.66 91.28 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.57 0.748 . . . . 42.42 111.099 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 126' ' ' LEU . 47.6 t -58.12 -53.11 50.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 C-N-CA 123.881 0.872 . . . . 72.34 111.003 178.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.612 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.5 pt20 -67.61 -29.6 68.97 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 116.536 -0.302 . . . . 70.51 111.731 -179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.5 t70 -66.06 -42.68 89.15 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 123.265 0.626 . . . . 72.22 109.935 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 19.2 mt -73.82 -41.82 61.76 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 116.463 -0.335 . . . . 71.32 110.538 -175.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.612 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.3 t -68.28 -26.21 65.54 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.208 0.203 . . . . 62.33 111.434 175.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.96 -48.97 66.91 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.928 0.491 . . . . 74.32 111.24 172.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.675 ' HB2' HD11 ' A' ' 137' ' ' LEU . 27.7 mt -75.15 -19.76 59.72 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.376 0.67 . . . . 71.32 111.704 178.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . . . . . . . . . 2.4 tt -74.21 -54.79 7.0 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 124.118 0.967 . . . . 72.41 108.862 174.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 44.8 t -63.57 -25.55 68.29 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 124.291 1.036 . . . . 74.12 112.478 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 35.6 t -141.97 85.46 1.93 Allowed 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.612 0.765 . . . . 70.11 109.677 178.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -80.46 -171.45 3.06 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.975 0.91 . . . . 71.24 111.892 178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -49.36 -36.26 21.1 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 124.391 1.076 . . . . 51.42 113.217 175.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 35.0 t70 . . . . . 0 CA--C 1.561 1.381 0 C-N-CA 123.76 0.824 . . . . 72.2 110.055 174.533 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 112.516 -0.233 . . . . 74.14 112.516 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.0 t -161.37 140.93 10.36 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.181 0.592 . . . . 73.52 111.55 177.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -87.0 -22.87 25.25 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.526 0.73 . . . . 72.41 110.726 171.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -69.74 -42.31 74.11 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.798 0.839 . . . . 63.31 111.152 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -74.8 97.16 3.21 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.916 0.487 . . . . 54.42 110.095 176.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.438 ' HB3' ' H ' ' A' ' 73' ' ' HIS . 8.9 m120 -91.55 126.13 36.53 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.983 0.913 . . . . 72.04 110.882 -174.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -76.04 135.76 39.93 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.323 0.582 . . . . 73.33 112.388 -174.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -83.0 -21.1 34.0 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 124.076 0.95 . . . . 74.54 112.215 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -56.59 -27.44 58.05 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 123.671 0.788 . . . . 64.43 112.952 -178.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.401 ' HB3' ' CG ' ' A' ' 76' ' ' TYR . 64.4 m -62.3 -48.03 81.65 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.938 0.495 . . . . 71.05 111.938 171.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.1 m95 -61.83 -24.98 67.23 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 113.613 0.968 . . . . 75.1 113.613 175.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 41.5 t -61.1 -28.32 69.0 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.342 0.657 . . . . 63.21 112.03 174.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.5 t -69.66 -40.42 79.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 123.919 0.888 . . . . 74.31 111.282 175.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 72.0 mt -79.72 -24.49 41.62 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.6 0.36 . . . . 72.25 111.626 177.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.458 ' O ' ' HG2' ' A' ' 18' ' ' ARG . 44.3 tt0 -51.96 -49.84 62.41 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 124.472 1.109 . . . . 72.43 113.988 -174.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.31 -23.73 49.09 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 114.159 0.423 . . . . 74.12 114.159 178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -108.23 -8.08 15.82 Favored 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 123.637 0.775 . . . . 71.22 111.754 -179.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.513 ' HD2' HD13 ' A' ' 65' ' ' LEU . 37.7 ptt180 -67.13 -25.28 66.1 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 118.744 0.702 . . . . 61.45 112.429 -169.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.0 p -57.71 -38.18 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 CA-C-O 121.439 0.638 . . . . 64.01 111.36 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.7 m -79.28 -40.06 31.41 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.377 1.071 . . . . 51.5 110.643 176.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.557 HD13 ' HE1' ' A' ' 79' ' ' PHE . 76.6 mt -64.75 -37.6 88.17 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 123.492 0.717 . . . . 63.34 112.505 -178.628 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.444 HG22 ' HB ' ' A' ' 61' ' ' VAL . 69.5 p -73.89 -24.11 59.67 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.224 0.609 . . . . 74.21 112.496 -178.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.3 p -88.15 -39.79 14.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.389 0.676 . . . . 71.13 112.282 176.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.437 HG11 HD21 ' A' ' 90' ' ' LEU . 98.1 t -78.56 -50.77 18.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 123.11 0.564 . . . . 73.13 112.346 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 3.6 mp -88.51 143.14 11.82 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 108.117 -1.068 . . . . 73.41 108.117 179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.442 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 3.2 p30 -122.92 140.38 33.25 Favored Pre-proline 0 C--O 1.254 1.336 0 CA-C-N 118.12 0.418 . . . . 72.35 110.626 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.432 ' O ' HG23 ' A' ' 31' ' ' THR . 34.6 Cg_exo -59.8 -20.78 60.74 Favored 'Trans proline' 0 C--N 1.38 2.231 0 C-N-CA 122.772 2.315 . . . . 65.41 113.522 -170.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.6 t -78.77 -22.69 46.02 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 117.785 0.266 . . . . 62.52 110.624 -172.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.543 ' HG3' HG23 ' A' ' 30' ' ' ILE . 14.1 ptp180 -84.15 -29.89 26.32 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 120.288 -0.565 . . . . 75.22 110.309 175.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.543 HG23 ' HG3' ' A' ' 29' ' ' ARG . 34.8 pt -102.7 1.99 10.56 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.204 0 N-CA-C 112.656 0.613 . . . . 72.12 112.656 -176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.432 HG23 ' O ' ' A' ' 27' ' ' PRO . 0.9 OUTLIER -57.46 -50.24 89.26 Favored Pre-proline 0 N--CA 1.496 1.86 0 CA-C-O 118.401 -0.809 . . . . 51.3 112.881 174.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -65.75 -33.52 43.76 Favored 'Trans proline' 0 C--N 1.392 2.834 0 C-N-CA 121.578 1.518 . . . . 64.4 112.277 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -67.78 -58.46 4.57 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.246 0.619 . . . . 71.14 111.479 -177.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.7 mt -60.83 -24.97 66.27 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.105 0.962 . . . . 74.13 112.37 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 8.1 mmt180 -61.48 -54.05 48.48 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.1 0.56 . . . . 64.22 111.125 169.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -66.51 -25.02 66.49 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.427 0.691 . . . . 72.24 111.984 178.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.0 m -77.72 -8.73 58.38 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.177 0.591 . . . . 74.01 112.138 172.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.504 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 10.6 mmpt? 73.12 15.31 4.48 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 125.151 1.38 . . . . 73.31 113.308 173.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 27.1 m -99.63 -34.02 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 112.723 0.638 . . . . 63.51 112.723 -177.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.401 HD11 HG22 ' A' ' 31' ' ' THR . 9.6 tt -80.18 116.02 20.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.096 0.559 . . . . 75.12 110.476 -179.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.6 m120 -82.17 147.48 57.41 Favored Pre-proline 0 CA--C 1.552 1.037 0 C-N-CA 123.296 0.638 . . . . 72.34 110.059 172.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.455 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 10.5 Cg_endo -53.2 -20.48 14.58 Favored 'Trans proline' 0 C--N 1.379 2.182 0 C-N-CA 122.901 2.4 . . . . 54.23 113.623 174.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -58.38 -46.06 87.06 Favored 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 123.946 0.899 . . . . 73.22 112.013 171.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -61.92 -62.77 1.55 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.331 0.652 . . . . 74.43 112.076 -175.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -49.26 -31.61 9.18 Favored 'General case' 0 CA--C 1.566 1.559 0 N-CA-C 112.838 0.681 . . . . 71.35 112.838 178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 21.4 mm-40 -72.53 -57.07 4.44 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 122.843 0.457 . . . . 70.5 111.576 175.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -61.12 -40.96 95.75 Favored 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 112.087 0.403 . . . . 74.1 112.087 -175.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 64.1 t -70.25 -46.87 70.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.932 0 C-N-CA 124.436 1.095 . . . . 74.12 111.576 -176.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -85.28 18.6 2.57 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 112.926 0.713 . . . . 71.54 112.926 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.3 m -88.78 6.78 37.2 Favored 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 123.77 0.828 . . . . 53.0 112.87 174.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.457 ' HA ' HD11 ' A' ' 56' ' ' ILE . 2.9 m-20 -41.39 112.71 1.01 Allowed Pre-proline 0 N--CA 1.499 2.022 0 N-CA-C 114.81 1.411 . . . . 73.24 114.81 -177.124 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_exo -75.75 -31.61 5.17 Favored 'Trans proline' 0 C--N 1.372 1.813 0 C-N-CA 122.355 2.037 . . . . 74.43 111.575 167.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -142.98 139.83 30.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.389 1.076 . . . . 71.45 109.782 -177.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.431 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.5 pt? -61.92 -0.57 0.5 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 114.567 1.321 . . . . 73.21 114.567 171.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 64.6 t -54.79 -29.31 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.631 0 C-N-CA 123.916 0.886 . . . . 63.23 112.352 171.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.457 HD11 ' HA ' ' A' ' 51' ' ' ASP . 30.7 pt -101.55 17.25 4.09 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 114.142 1.164 . . . . 71.23 114.142 -174.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 65.4 mtm180 -50.17 -46.77 54.49 Favored 'General case' 0 N--CA 1.503 2.194 0 N-CA-C 113.613 0.968 . . . . 71.4 113.613 179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 22' ' ' THR . 36.1 ttpt -72.8 -34.44 66.9 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 115.518 -0.765 . . . . 65.41 111.925 -174.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptm180 -77.53 -17.08 58.27 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.856 -0.527 . . . . 74.31 111.791 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -51.11 -54.07 28.47 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.547 0.739 . . . . 55.22 112.12 175.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.534 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 12.1 t -69.81 -31.7 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 N-CA-C 109.979 -0.378 . . . . 52.03 109.979 175.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.71 -41.94 97.71 Favored Glycine 0 CA--C 1.539 1.535 0 N-CA-C 114.488 0.555 . . . . 34.04 114.488 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.8 m -76.96 -33.34 20.63 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 122.862 0.465 . . . . 73.12 111.363 175.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 23.8 tp -56.93 -37.41 71.44 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.088 0.955 . . . . 75.04 111.585 168.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.2 mt -57.14 -41.88 79.95 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.135 0.574 . . . . 74.53 111.59 179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -61.29 -36.4 79.97 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.073 0.549 . . . . 72.51 112.48 175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 66.6 mt -77.08 -22.55 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 CA-C-O 121.4 0.619 . . . . 74.32 110.863 176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 87.4 mt -83.19 -24.05 32.61 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 123.159 0.584 . . . . 74.43 111.02 169.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.8 mt-30 -86.9 -20.03 27.99 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 124.205 1.002 . . . . 74.21 111.829 177.465 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -75.04 -26.4 59.42 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 109.547 -0.538 . . . . 71.25 109.547 169.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.1 p -94.72 3.49 54.98 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 124.061 0.944 . . . . 34.32 110.67 170.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 41.93 -107.99 0.12 Allowed Glycine 0 C--N 1.368 2.351 0 N-CA-C 117.059 1.584 . . . . 74.52 117.059 174.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.438 ' H ' ' HB3' ' A' ' 6' ' ' ASN . 15.4 t60 -63.96 -35.28 80.17 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 124.183 0.993 . . . . 75.22 110.896 -177.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -66.87 -47.78 70.83 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.177 0.591 . . . . 73.31 111.755 179.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.58 -40.15 98.78 Favored Glycine 0 N--CA 1.475 1.273 0 O-C-N 123.381 0.426 . . . . 61.24 112.812 176.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.435 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 51.1 t80 -51.25 -62.22 1.75 Allowed 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.431 1.092 . . . . 63.03 111.868 170.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.493 ' HA ' HD12 ' A' ' 80' ' ' LEU . 87.7 t -59.68 -41.96 86.94 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.307 0.643 . . . . 52.11 111.773 -178.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -41.2 93.4 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.66 0.784 . . . . 75.13 112.312 178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.557 ' HE1' HD13 ' A' ' 21' ' ' LEU . 68.0 t80 -68.62 -41.52 79.37 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 123.188 0.595 . . . . 72.43 110.905 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.493 HD12 ' HA ' ' A' ' 77' ' ' VAL . 87.7 mt -52.32 -48.06 65.64 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 122.68 0.392 . . . . 61.01 110.948 171.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -65.7 -40.16 91.99 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.864 1.266 . . . . 72.11 112.755 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.2 p -64.56 -29.71 70.73 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 120.898 0.38 . . . . 71.42 110.229 174.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.55 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 9.7 mp -79.29 -29.72 42.6 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 122.066 -0.396 . . . . 75.23 111.954 169.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -63.71 -29.18 70.43 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.659 -0.651 . . . . 74.2 110.632 176.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -96.87 -54.51 3.18 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 123.204 0.601 . . . . 73.32 111.032 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -82.87 -57.93 3.09 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 113.672 0.99 . . . . 74.13 113.672 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.411 ' HB3' HD23 ' A' ' 90' ' ' LEU . 70.5 m-85 -125.03 80.01 64.62 Favored Pre-proline 0 N--CA 1.502 2.168 0 CA-C-N 118.276 0.489 . . . . 71.13 112.212 -175.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -68.81 -24.16 34.64 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.768 2.312 . . . . 73.31 113.771 -174.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.423 ' HG3' HD22 ' A' ' 90' ' ' LEU . 13.4 pt20 -75.38 -38.17 60.16 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 122.922 0.489 . . . . 71.11 111.617 174.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' O ' HG13 ' A' ' 94' ' ' VAL . 4.2 mm? -62.41 -33.67 75.23 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.824 0.45 . . . . 71.42 110.729 171.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.556 ' O ' HG22 ' A' ' 95' ' ' THR . 89.8 t80 -66.86 -53.21 34.62 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 122.636 0.375 . . . . 73.1 110.768 169.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 98' ' ' GLU . 23.7 tptm -46.71 -43.47 17.91 Favored 'General case' 0 N--CA 1.493 1.682 0 C-N-CA 124.938 1.295 . . . . 71.32 112.614 -179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.58 -44.86 56.25 Favored 'General case' 0 CA--C 1.563 1.462 0 N-CA-C 112.862 0.69 . . . . 75.32 112.862 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 21' ' ' LEU . 33.0 m -63.96 -43.81 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 N-CA-C 113.949 1.092 . . . . 74.02 113.949 -176.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.556 HG22 ' O ' ' A' ' 91' ' ' TYR . 10.7 t -89.47 -24.38 21.85 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 112.15 0.426 . . . . 62.14 112.15 -173.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.67 -19.92 51.24 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-O 119.943 -0.365 . . . . 42.33 113.817 175.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.62 176.11 5.33 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-N 117.77 0.785 . . . . 71.11 110.929 176.286 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.449 ' HA ' ' HD3' ' A' ' 92' ' ' LYS . 44.8 mt-10 -65.19 150.49 95.47 Favored Pre-proline 0 CA--C 1.558 1.284 0 N-CA-C 113.17 0.804 . . . . 74.21 113.17 -178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -46.58 109.04 0.18 Allowed 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.619 2.879 . . . . 62.32 113.86 168.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.01 -16.8 27.35 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.73 0.812 . . . . 62.45 112.331 -172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.2 53.38 0.45 Allowed 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 124.83 1.252 . . . . 71.13 110.224 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.6 t -76.07 46.0 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 C-N-CA 124.735 1.214 . . . . 74.43 112.53 -177.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' A' ' 107' ' ' ILE . 41.4 m-85 -68.71 -6.67 27.63 Favored 'General case' 0 CA--C 1.558 1.274 0 N-CA-C 113.975 1.102 . . . . 74.41 113.975 -177.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 48.3 t -61.8 -23.13 66.02 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-N 118.829 0.741 . . . . 62.55 112.783 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.3 tpt -67.19 -57.12 7.33 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 123.547 0.739 . . . . 63.44 111.05 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.12 -34.71 68.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 C-N-CA 123.584 0.754 . . . . 63.32 110.889 176.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.455 HG12 ' O ' ' A' ' 103' ' ' PHE . 40.7 mm -59.67 -46.98 92.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 123.526 0.73 . . . . 74.15 111.241 173.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -73.56 -35.37 65.47 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 112.446 0.536 . . . . 70.11 112.446 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.39 -46.55 72.93 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.709 0.804 . . . . 75.42 112.4 -170.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 80.1 p -123.26 -38.99 2.51 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.267 0.627 . . . . 33.21 111.647 -179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.42 159.26 8.03 Favored Glycine 0 CA--C 1.534 1.235 0 CA-C-N 116.279 -0.419 . . . . 70.43 113.408 -178.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -57.66 -40.68 79.89 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.517 0.727 . . . . 75.44 111.823 173.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 89.5 p -59.28 -33.41 71.03 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.861 0.864 . . . . 73.22 111.716 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.64 -53.17 45.76 Favored Glycine 0 C--N 1.351 1.41 0 O-C-N 123.01 0.194 . . . . 62.22 113.326 175.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 27.7 tp -63.55 -32.07 73.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.013 0.525 . . . . 73.44 111.557 175.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 94.8 m -60.09 -43.53 95.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.538 0.735 . . . . 73.24 110.463 172.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -64.4 -47.02 80.75 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.283 0.633 . . . . 74.11 111.666 176.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -55.39 -50.33 70.02 Favored 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 123.714 0.806 . . . . 61.11 111.945 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 50.8 mt -66.94 -44.29 80.99 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.3 -0.864 . . . . 61.44 111.724 177.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.6 tpt -55.95 -40.55 73.34 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 123.71 0.804 . . . . 72.11 113.021 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -77.04 -38.67 52.3 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 122.032 -0.417 . . . . 70.43 111.446 173.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -62.49 -32.12 72.97 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.232 0.613 . . . . 72.15 112.516 -177.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.467 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.8 m -67.47 -25.47 33.37 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 C-N-CA 122.17 0.188 . . . . 74.53 111.391 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 63.6 mtm -82.97 -37.01 24.64 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 123.026 0.53 . . . . 64.33 110.155 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.468 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 36.4 mtpt -58.47 -43.46 88.92 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.066 0.946 . . . . 73.22 111.228 170.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 18.5 mt -75.45 -35.8 60.84 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 114.79 -1.095 . . . . 73.25 111.266 178.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -62.28 -35.54 79.31 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.882 0.473 . . . . 73.23 110.896 173.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 tptp -72.37 -44.26 62.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.51 0.724 . . . . 44.41 109.626 176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.488 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.5 tptt -59.27 -40.7 86.92 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.057 0.943 . . . . 73.31 111.539 176.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 24.5 t -66.14 -53.74 34.05 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.672 0.789 . . . . 62.11 110.736 178.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.59 ' HA ' HG22 ' A' ' 134' ' ' THR . 1.6 pt20 -65.82 -27.23 68.1 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.221 0.209 . . . . 73.41 111.143 -177.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.528 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 25.1 t70 -63.19 -51.86 64.63 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 123.329 0.652 . . . . 54.32 109.827 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 15.2 mt -68.99 -38.89 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.059 -0.518 . . . . 75.35 111.055 -174.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.59 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.0 t -71.72 -26.23 62.4 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.328 0.251 . . . . 74.54 111.39 177.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.96 -46.94 70.01 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.789 0.436 . . . . 42.54 110.498 170.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 46.7 mt -69.45 -26.54 64.64 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.729 0.812 . . . . 63.34 111.336 177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.2 tt -74.33 -58.92 2.98 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.393 1.077 . . . . 45.45 108.62 178.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.0 t -57.83 -30.52 65.81 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 124.085 0.954 . . . . 61.13 112.732 179.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.3 t -139.62 97.1 3.19 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.61 0.764 . . . . 74.34 109.913 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.655 ' HD3' ' HB2' ' B' ' 142' ' ' ASP . 9.0 mtpm? -88.11 -168.35 2.18 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.902 0.881 . . . . 71.41 111.534 178.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -70.43 -19.56 62.97 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 122.782 0.433 . . . . 62.43 111.771 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 . . . . . 0 CA--C 1.563 1.446 0 C-N-CA 123.709 0.804 . . . . 73.44 110.005 172.316 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.003 0 CA-C-O 120.271 -0.183 . . . . 64.41 113.205 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 44.7 t -166.62 103.41 0.59 Allowed 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.539 0.736 . . . . 74.14 110.46 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -92.54 -31.75 15.1 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.643 0.777 . . . . 72.11 111.742 176.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 45.9 m-85 -100.94 -57.74 2.03 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.807 0.843 . . . . 75.11 112.56 -174.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.62 70.72 5.01 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.972 0.892 . . . . 72.3 111.799 -177.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.475 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 17.6 m120 -91.76 114.93 27.59 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.83 0.852 . . . . 64.42 110.129 -176.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -66.78 132.63 48.46 Favored 'General case' 0 CA--C 1.557 1.212 0 CA-C-O 121.276 0.56 . . . . 63.54 112.07 -171.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -79.81 -14.66 58.53 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.65 0.78 . . . . 72.04 110.907 175.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -57.36 -22.79 44.93 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 124.238 1.015 . . . . 73.53 112.729 177.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.444 ' HB3' ' CG ' ' B' ' 76' ' ' TYR . 72.7 m -51.39 -55.1 20.4 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.293 1.037 . . . . 72.12 112.396 171.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 93.0 m95 -64.04 -22.32 66.88 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.733 0.813 . . . . 73.23 112.702 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 59.3 m -59.93 -26.25 65.8 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 112.969 0.729 . . . . 63.52 112.969 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 72.1 t -63.7 -57.58 11.12 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 C-N-CA 122.859 0.464 . . . . 75.23 110.256 170.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 78.5 mt -75.67 -18.35 59.67 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.318 0.859 . . . . 75.22 113.318 -173.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -46.71 -59.15 3.22 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 124.244 1.018 . . . . 75.44 113.247 -175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.28 -21.33 66.21 Favored Glycine 0 CA--C 1.536 1.356 0 N-CA-C 113.894 0.318 . . . . 65.25 113.894 178.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -96.3 -4.44 42.17 Favored 'General case' 0 C--O 1.246 0.919 0 C-N-CA 123.542 0.737 . . . . 74.53 111.769 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.404 ' HA ' ' HB2' ' B' ' 21' ' ' LEU . 57.2 mtm180 -62.3 -25.16 67.71 Favored 'General case' 0 C--O 1.203 -1.344 0 CA-C-O 119.316 -0.373 . . . . 61.41 111.174 179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.55 -40.57 42.24 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.722 0 C-N-CA 123.258 0.623 . . . . 75.42 112.169 172.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 52.3 m -80.34 -46.16 16.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.607 0.763 . . . . 50.45 110.606 175.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.404 ' HB2' ' HA ' ' B' ' 18' ' ' ARG . 88.9 mt -59.48 -30.59 68.65 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 112.685 0.624 . . . . 75.42 112.685 -177.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' B' ' 58' ' ' LYS . 77.2 p -87.99 -19.35 27.32 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.556 0.742 . . . . 74.33 112.321 -179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 40.2 t -79.31 -35.45 41.13 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.284 0.633 . . . . 62.53 110.834 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.461 HG21 HD11 ' B' ' 90' ' ' LEU . 86.6 t -94.7 -61.89 1.98 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.299 0 N-CA-C 113.706 1.002 . . . . 51.11 113.706 -174.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.2 mp -66.51 133.31 31.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 C-N-CA 123.16 0.584 . . . . 71.23 111.306 -167.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -101.54 108.44 55.56 Favored Pre-proline 0 C--O 1.256 1.428 0 C-N-CA 123.367 0.667 . . . . 71.51 111.134 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.578 ' HD3' HG22 ' B' ' 61' ' ' VAL . 87.1 Cg_exo -48.08 -38.28 31.91 Favored 'Trans proline' 0 C--N 1.388 2.636 0 C-N-CA 124.069 3.179 . . . . 75.24 114.117 -176.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 93.9 p -76.53 -20.31 57.03 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 112.111 0.412 . . . . 60.45 112.111 -170.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -95.87 -12.36 25.32 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 118.705 0.684 . . . . 72.33 112.163 176.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 42.2 pt -101.04 -13.79 8.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 C-N-CA 122.563 0.345 . . . . 71.22 111.88 174.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.582 HG22 HD11 ' B' ' 40' ' ' LEU . 12.5 p -52.54 -46.36 95.46 Favored Pre-proline 0 N--CA 1.497 1.904 0 CA-C-O 117.726 -1.13 . . . . 74.42 113.687 176.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.413 ' HD3' ' OG1' ' B' ' 31' ' ' THR . 32.1 Cg_exo -59.88 -40.1 65.82 Favored 'Trans proline' 0 C--N 1.401 3.31 0 C-N-CA 121.822 1.681 . . . . 72.33 113.238 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -67.44 -53.29 30.3 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.096 -0.502 . . . . 74.21 110.569 -179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.455 HD13 HD11 ' B' ' 68' ' ' LEU . 89.2 mt -59.85 -30.88 69.26 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.573 0.749 . . . . 71.5 112.404 -178.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.551 ' HG2' HD22 ' B' ' 40' ' ' LEU . 33.0 mmm-85 -57.11 -55.04 39.84 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.155 0.982 . . . . 61.54 111.344 171.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -62.69 -28.35 69.88 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.362 1.065 . . . . 70.3 112.272 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -78.52 -6.53 55.7 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.566 0.746 . . . . 60.21 112.602 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.573 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 10.7 mmpt? 77.09 6.09 3.18 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 125.302 1.441 . . . . 61.23 112.842 173.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 22.3 m -91.52 -36.41 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 N-CA-C 112.163 0.431 . . . . 74.21 112.163 -175.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.817 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.0 tt -86.6 118.09 25.79 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.649 0.779 . . . . 71.24 110.443 -179.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -87.5 164.53 34.72 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.676 1.19 . . . . 70.21 111.645 -177.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -65.73 -17.5 56.55 Favored 'Trans proline' 0 C--N 1.383 2.368 0 C-N-CA 122.102 1.868 . . . . 51.55 113.458 178.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -80.93 -47.64 13.42 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.913 0.885 . . . . 75.15 112.194 -177.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.598 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.9 OUTLIER -72.71 -40.33 66.25 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 112.287 0.477 . . . . 54.02 112.287 -172.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.817 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.2 pt-20 -51.65 -37.74 51.73 Favored 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 117.911 0.323 . . . . 70.22 111.73 169.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -70.88 -58.22 3.82 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 122.717 0.407 . . . . 73.52 111.169 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.534 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.6 pt20 -69.59 -29.52 67.08 Favored 'General case' 0 N--CA 1.495 1.814 0 N-CA-C 113.969 1.1 . . . . 75.33 113.969 -171.212 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.533 HG22 HG23 ' B' ' 63' ' ' VAL . 61.7 t -71.12 -34.4 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 C-N-CA 123.199 0.599 . . . . 70.14 111.039 174.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -103.12 15.01 30.45 Favored 'General case' 0 CA--C 1.568 1.673 0 C-N-CA 123.347 0.659 . . . . 70.42 111.779 177.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.2 t -81.69 7.83 11.44 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 124.234 1.014 . . . . 73.21 112.968 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -81.67 135.95 48.81 Favored Pre-proline 0 CA--C 1.559 1.306 0 C-N-CA 123.908 0.883 . . . . 71.51 111.47 -177.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -79.66 -0.88 11.06 Favored 'Trans proline' 0 C--N 1.371 1.761 0 C-N-CA 122.646 2.231 . . . . 74.43 112.767 171.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.49 ' HB3' HG23 ' B' ' 55' ' ' VAL . 82.4 m-20 -157.25 136.0 11.54 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.975 1.31 . . . . 61.14 110.007 -171.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.49 ' H ' HD23 ' B' ' 54' ' ' LEU . 0.6 OUTLIER -89.93 19.19 5.02 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.475 0.71 . . . . 71.35 111.421 178.245 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' B' ' 53' ' ' ASN . 84.5 t -56.64 -36.51 48.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 124.165 0.986 . . . . 75.11 111.014 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.437 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 49.6 pt -98.84 24.28 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.325 0 C-N-CA 124.026 0.93 . . . . 64.42 112.7 -179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.509 ' HA ' ' HD3' ' B' ' 60' ' ' LYS . 38.9 ptt180 -55.4 -25.08 33.54 Favored 'General case' 0 N--CA 1.499 1.975 0 N-CA-C 113.416 0.895 . . . . 63.2 113.416 -177.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.504 ' O ' ' HB ' ' B' ' 22' ' ' THR . 5.3 tppp? -58.44 -63.0 1.43 Allowed 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 123.892 0.877 . . . . 72.25 110.529 172.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.437 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 12.0 ptp180 -70.81 -20.17 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 CA-C-O 119.324 -0.369 . . . . 50.24 111.966 -177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' B' ' 57' ' ' ARG . 17.5 mtpp -60.72 -43.76 97.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.315 0.646 . . . . 73.44 111.725 176.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.578 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.7 t -69.55 -42.09 80.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 N-CA-C 109.538 -0.542 . . . . 64.31 109.538 175.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.91 -45.47 95.79 Favored Glycine 0 C--N 1.349 1.275 0 CA-C-N 114.774 -1.103 . . . . 73.31 113.889 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.533 HG23 HG22 ' B' ' 48' ' ' VAL . 31.2 m -67.01 -40.34 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 122.909 0.484 . . . . 74.11 110.369 -178.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' B' ' 68' ' ' LEU . 55.9 tp -56.2 -44.91 79.93 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.051 0.541 . . . . 71.32 110.981 175.188 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 79.0 mt -63.35 -47.33 82.59 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.399 0.68 . . . . 54.2 111.454 177.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.72 -32.54 69.29 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.764 0.826 . . . . 72.41 112.005 176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.598 HG21 ' HB3' ' B' ' 44' ' ' ASP . 57.5 mt -75.84 -47.53 32.43 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.113 0 CA-C-O 119.246 -0.407 . . . . 64.02 110.345 175.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.455 HD11 HD13 ' B' ' 34' ' ' LEU . 99.1 mt -58.65 -21.84 55.15 Favored 'General case' 0 N--CA 1.502 2.138 0 C-N-CA 123.829 0.852 . . . . 60.31 112.514 177.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -56.47 -19.01 13.27 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 113.57 0.952 . . . . 73.42 113.57 168.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -59.08 -27.54 65.65 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.824 0.849 . . . . 74.51 111.829 174.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 64.3 p -100.86 9.0 42.86 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.185 0.994 . . . . 74.33 111.324 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.85 -110.21 0.44 Allowed Glycine 0 C--N 1.362 2.024 0 N-CA-C 116.264 1.266 . . . . 31.24 116.264 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.475 ' H ' ' HB3' ' B' ' 6' ' ' ASN . 49.7 t60 -61.92 -38.41 88.29 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.659 1.184 . . . . 73.1 111.248 -178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 50.6 mtmt -62.57 -48.82 77.8 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.587 0.755 . . . . 60.23 112.973 -175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.09 -39.71 97.49 Favored Glycine 0 N--CA 1.479 1.553 0 CA-C-N 116.35 -0.386 . . . . 75.03 112.851 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.464 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 93.7 t80 -59.34 -49.17 78.85 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.482 0.713 . . . . 73.04 111.297 173.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.469 HG23 ' O ' ' B' ' 73' ' ' HIS . 89.6 t -58.61 -43.89 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 C-N-CA 123.545 0.738 . . . . 54.22 111.475 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.1 -37.06 85.71 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 115.645 -0.707 . . . . 73.2 111.847 177.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -69.81 -37.13 76.16 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.719 0.408 . . . . 74.22 110.863 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' B' ' 76' ' ' TYR . 94.8 mt -56.22 -47.05 79.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.375 0.67 . . . . 64.53 111.683 171.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -65.07 -44.27 89.46 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.048 0.939 . . . . 75.12 112.495 178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 95.9 p -65.71 -32.06 73.41 Favored 'General case' 0 N--CA 1.485 1.318 0 CA-C-O 120.819 0.342 . . . . 61.32 110.673 178.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.617 ' HG ' ' HB2' ' B' ' 87' ' ' TYR . 9.5 mp -76.31 -33.26 59.04 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 122.754 0.422 . . . . 62.3 111.278 169.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.512 ' HG2' ' HA ' ' B' ' 101' ' ' ARG . 5.0 tp10 -66.78 -25.54 66.53 Favored 'General case' 0 N--CA 1.483 1.219 0 CA-C-O 121.009 0.433 . . . . 71.33 111.274 -178.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.7 tt -97.56 -54.8 3.01 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 123.778 0.831 . . . . 71.22 110.331 175.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 92.0 m-85 -90.83 -50.32 5.96 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 113.794 1.035 . . . . 73.25 113.794 -170.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.617 ' HB2' ' HG ' ' B' ' 83' ' ' LEU . 88.3 m-85 -123.62 67.79 40.03 Favored Pre-proline 0 N--CA 1.51 2.55 0 CA-C-N 119.141 0.882 . . . . 64.1 113.091 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.62 -45.74 1.55 Allowed 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 122.099 1.866 . . . . 74.21 113.848 -171.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' B' ' 90' ' ' LEU . 10.5 pt20 -59.65 -22.18 61.54 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.58 1.152 . . . . 71.13 112.854 178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.461 HD11 HG21 ' B' ' 24' ' ' VAL . 4.5 mm? -70.36 -45.22 66.52 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.123 0.569 . . . . 52.22 112.144 177.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.441 ' HA ' HG22 ' B' ' 94' ' ' VAL . 37.1 t80 -73.34 -38.56 65.71 Favored 'General case' 0 C--O 1.252 1.214 0 CA-C-N 118.116 0.416 . . . . 74.4 110.206 175.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.11 -44.72 75.22 Favored 'General case' 0 CA--C 1.553 1.096 0 CA-C-N 115.366 -0.834 . . . . 72.55 112.536 175.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -71.24 -41.11 70.54 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.289 0.495 . . . . 65.4 112.03 -179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 91' ' ' TYR . 28.5 m -71.28 -44.9 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 112.285 0.476 . . . . 54.4 112.285 -173.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 48.7 p -92.81 -47.03 7.25 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 112.688 0.625 . . . . 55.34 112.688 178.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 117.84 -7.77 15.06 Favored Glycine 0 N--CA 1.474 1.223 0 CA-C-N 116.405 -0.362 . . . . 15.41 112.909 -171.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.45 -179.57 5.97 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 117.351 0.576 . . . . 73.23 111.611 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -89.08 150.07 44.44 Favored Pre-proline 0 N--CA 1.487 1.395 0 C-N-CA 123.706 0.803 . . . . 72.23 110.084 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.438 ' HB3' ' HB3' ' B' ' 80' ' ' LEU . 93.8 Cg_exo -45.61 -61.02 0.66 Allowed 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.32 2.68 . . . . 64.31 114.574 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . 159.36 -18.04 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.341 0 C-N-CA 125.937 1.695 . . . . 42.12 109.968 -175.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.512 ' HA ' ' HG2' ' B' ' 84' ' ' GLU . 24.2 mtm180 72.89 52.67 0.14 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 125.269 1.428 . . . . 72.11 109.649 -172.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.61 44.05 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.627 0 C-N-CA 124.189 0.995 . . . . 70.14 112.184 -176.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.505 ' O ' HG12 ' B' ' 107' ' ' ILE . 87.6 m-85 -59.07 -19.3 42.93 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.709 0.803 . . . . 71.32 112.01 174.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.427 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 33.8 t -63.06 -15.91 58.15 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.635 0.774 . . . . 75.01 112.087 177.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 13.0 tpt -68.28 -59.77 2.95 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 124.292 1.037 . . . . 74.23 110.59 171.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -27.97 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.189 0.596 . . . . 62.44 111.061 176.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.532 HD12 ' HG3' ' B' ' 112' ' ' GLU . 44.0 mm -68.79 -46.0 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 123.531 0.732 . . . . 65.34 111.611 173.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -67.29 -34.36 77.23 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.88 -0.513 . . . . 64.34 111.371 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.573 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.67 -56.37 4.87 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.785 0.834 . . . . 65.31 113.058 -175.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 93.9 p -124.22 8.21 8.52 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 113.078 0.77 . . . . 72.41 113.078 -173.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.69 170.71 44.62 Favored Glycine 0 N--CA 1.475 1.289 0 N-CA-C 113.816 0.286 . . . . 30.43 113.816 178.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.532 ' HG3' HD12 ' B' ' 107' ' ' ILE . 1.9 mp0 -64.12 -31.15 72.24 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.618 0.367 . . . . 51.55 110.911 173.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.0 p -61.3 -36.55 80.41 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 123.726 0.642 . . . . 54.41 111.806 175.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.89 -53.46 45.64 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 123.115 0.259 . . . . 73.1 113.216 175.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 32.4 tp -66.65 -37.58 85.08 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.372 0.669 . . . . 74.52 111.722 178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 48.9 m -59.28 -44.3 92.48 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.758 0.823 . . . . 73.05 110.344 175.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.441 ' O ' HG22 ' B' ' 121' ' ' THR . 25.3 mt-30 -73.62 -30.93 63.27 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.757 0.651 . . . . 72.04 112.757 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 83.1 mt -60.2 -47.08 87.48 Favored 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 121.274 0.559 . . . . 60.3 110.89 171.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -71.21 -39.77 71.55 Favored 'General case' 0 CA--C 1.556 1.19 0 CA-C-N 115.489 -0.778 . . . . 74.35 111.787 178.586 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.457 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.9 tpt -59.85 -45.26 92.98 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.376 1.07 . . . . 74.41 112.492 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . 0.441 HG22 ' O ' ' B' ' 117' ' ' GLN . 10.4 t -71.11 -35.51 71.8 Favored 'General case' 0 N--CA 1.48 1.037 0 O-C-N 122.057 -0.402 . . . . 70.51 111.224 173.287 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -58.78 -39.19 80.35 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 122.785 0.434 . . . . 73.43 111.986 178.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.457 HG22 ' O ' ' B' ' 120' ' ' MET . 10.2 m -69.69 -22.34 25.02 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 CA-C-O 119.469 -0.3 . . . . 73.42 111.569 176.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.1 mtm -79.48 -39.37 32.31 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 117.978 0.354 . . . . 65.32 110.151 176.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.453 ' HB3' ' HE2' ' B' ' 125' ' ' LYS . 42.2 mtpt -54.04 -52.89 59.44 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.217 1.007 . . . . 73.04 110.497 169.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.593 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 32.1 mt -64.08 -38.08 89.78 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 114.272 -1.331 . . . . 53.42 112.499 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -65.53 -42.09 92.34 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.782 0.433 . . . . 62.14 111.173 177.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 5.7 mptp? -69.83 -34.19 73.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.154 0.581 . . . . 74.31 110.917 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.532 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.5 tptt -64.18 -46.98 81.6 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 123.238 0.615 . . . . 42.42 110.547 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 46.2 t -57.75 -48.7 82.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.949 0.9 . . . . 72.34 111.435 178.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.629 ' HA ' HG22 ' B' ' 134' ' ' THR . 0.9 OUTLIER -69.52 -31.02 68.99 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.679 0.251 . . . . 70.51 111.679 179.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -65.07 -39.02 92.66 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.022 0.529 . . . . 72.22 110.761 174.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.566 HD13 ' HB ' ' A' ' 134' ' ' THR . 20.4 mt -78.7 -39.83 35.47 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 115.869 -0.605 . . . . 71.32 110.836 -175.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.629 HG22 ' HA ' ' B' ' 131' ' ' GLN . 14.3 t -69.91 -30.82 68.32 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 122.283 0.233 . . . . 62.33 110.968 177.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.15 87.61 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.319 0.648 . . . . 74.32 111.896 175.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 137' ' ' LEU . 48.6 mt -76.09 -41.96 48.72 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 115.966 -0.561 . . . . 71.32 111.214 -178.877 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.2 tt -51.32 -44.58 61.98 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 124.454 1.102 . . . . 72.41 111.018 169.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 43.6 t -62.55 -45.46 92.85 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.264 0.625 . . . . 74.12 112.273 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 22.8 t -129.85 72.67 1.49 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-O 121.525 0.678 . . . . 70.11 110.834 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.546 ' HG2' ' H ' ' B' ' 141' ' ' ASP . 47.8 tttm -98.67 178.79 4.88 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.574 0.75 . . . . 71.24 110.32 178.523 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . 0.546 ' H ' ' HG2' ' B' ' 140' ' ' LYS . 3.2 m-20 -43.43 -47.06 6.95 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 125.103 1.361 . . . . 51.42 111.586 167.777 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . 0.655 ' HB2' ' HD3' ' A' ' 140' ' ' LYS . 7.6 m-20 . . . . . 0 CA--C 1.557 1.216 0 C-N-CA 124.74 1.216 . . . . 72.2 110.978 -175.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.256 0 CA-C-O 119.762 -0.465 . . . . 74.14 113.237 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 42.7 m -60.82 102.59 0.2 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.985 0.914 . . . . 73.52 112.406 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -87.52 145.18 26.35 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.643 0.777 . . . . 72.41 111.376 179.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -94.82 -6.49 42.72 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.517 0.727 . . . . 63.31 112.821 -172.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -78.72 71.94 5.21 Favored 'General case' 0 N--CA 1.485 1.325 0 CA-C-O 122.069 0.938 . . . . 54.42 110.187 179.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -100.7 114.74 28.74 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.13 0.972 . . . . 72.04 110.144 -176.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -86.83 86.36 7.32 Favored 'General case' 0 CA--C 1.556 1.204 0 CA-C-O 122.222 1.01 . . . . 73.33 111.748 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -73.87 -12.68 60.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-N 115.851 -0.613 . . . . 74.54 111.675 173.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -59.34 -28.94 67.28 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.197 0.599 . . . . 64.43 112.091 172.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 88.3 m -63.16 -49.83 72.77 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 121.067 0.46 . . . . 71.05 110.449 169.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -66.8 -20.16 65.89 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 113.288 0.847 . . . . 75.1 113.288 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.533 ' HA ' ' HB2' ' A' ' 15' ' ' GLU . 50.6 m -68.31 -27.3 66.17 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 122.802 0.441 . . . . 63.21 110.984 173.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.5 t -69.54 -36.12 69.61 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.337 0 C-N-CA 122.998 0.519 . . . . 74.31 110.632 173.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 44.1 mt -86.16 -14.11 45.05 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 112.575 0.583 . . . . 72.25 112.575 174.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 12' ' ' SER . 33.5 tt0 -53.14 -55.4 24.37 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 113.748 1.018 . . . . 72.43 113.748 -165.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.86 -23.78 65.93 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 116.178 -0.465 . . . . 74.12 113.581 176.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 92.8 m-85 -88.38 -11.27 46.65 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.395 0.678 . . . . 71.22 111.548 178.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -60.9 -25.89 67.06 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 118.587 0.63 . . . . 61.45 112.251 -177.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.4 p -59.09 -36.46 62.67 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 123.154 0.581 . . . . 64.01 111.569 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 15.0 m -85.79 -39.83 16.69 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.727 0.811 . . . . 51.5 110.858 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.538 HD23 HD12 ' A' ' 90' ' ' LEU . 87.5 mt -58.81 -38.14 77.96 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 123.71 0.804 . . . . 63.34 111.912 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 39.8 p -73.38 -28.31 61.95 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.087 0.555 . . . . 74.21 111.893 176.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.4 t -80.92 -35.06 32.91 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.439 0.696 . . . . 71.13 111.958 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 84.1 t -96.54 -52.7 8.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 123.44 0.696 . . . . 73.13 112.696 -175.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.405 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.4 mp -75.77 141.1 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 123.015 0.526 . . . . 73.41 110.644 -174.462 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.56 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 25.0 t70 -115.59 119.85 37.11 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 123.355 0.662 . . . . 72.35 110.416 174.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.578 ' HB3' HD22 ' A' ' 64' ' ' LEU . 52.3 Cg_exo -57.23 -30.67 88.22 Favored 'Trans proline' 0 C--N 1.369 1.608 0 C-N-CA 123.128 2.552 . . . . 65.41 113.786 -176.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.7 t -77.5 -17.56 57.88 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 122.812 0.445 . . . . 62.52 110.84 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 11.6 ptm180 -92.06 -16.6 26.2 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 122.332 -0.23 . . . . 75.22 111.013 177.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 35.9 pt -112.13 -3.93 10.94 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 N-CA-C 113.081 0.771 . . . . 72.12 113.081 -179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.407 HG23 ' O ' ' A' ' 27' ' ' PRO . 1.1 p -53.35 -47.55 95.76 Favored Pre-proline 0 N--CA 1.499 1.978 0 N-CA-C 113.816 1.043 . . . . 51.3 113.816 178.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_exo -62.88 -36.65 59.78 Favored 'Trans proline' 0 C--N 1.398 3.149 0 C-N-CA 121.924 1.75 . . . . 64.4 112.788 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -64.49 -46.63 82.18 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.164 0.586 . . . . 71.14 110.617 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.3 mt -66.66 -27.83 67.98 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.285 0.634 . . . . 74.13 112.392 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 27.0 mmm180 -64.06 -49.33 72.72 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.953 0.501 . . . . 64.22 110.616 168.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.446 ' HG3' HD11 ' A' ' 118' ' ' LEU . 18.3 mm100 -62.27 -25.31 67.78 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.668 0.787 . . . . 72.24 112.64 176.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 99.4 m -83.99 -6.85 59.49 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.992 0.517 . . . . 74.01 112.394 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.04 46.22 2.22 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.196 0.998 . . . . 73.31 111.661 174.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.422 HG12 ' HB3' ' A' ' 74' ' ' LYS . 32.9 m -132.41 -39.68 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.299 0.64 . . . . 63.51 111.184 -176.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.567 HD21 ' HB3' ' A' ' 45' ' ' GLU . 9.0 tt -86.0 122.68 30.38 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 123.687 0.795 . . . . 75.12 109.041 179.044 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -97.32 159.92 30.1 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.187 0.995 . . . . 72.34 110.089 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -54.12 -30.62 61.33 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.036 2.491 . . . . 54.23 113.969 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -67.27 -38.94 85.91 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.104 0.962 . . . . 73.22 111.45 177.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.569 ' HB3' HD13 ' A' ' 67' ' ' ILE . 69.5 m-20 -67.36 -37.98 84.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.802 0.841 . . . . 74.43 112.806 -179.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.567 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.8 pt-20 -79.79 -16.36 55.67 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 116.678 -0.237 . . . . 71.35 110.767 176.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -73.88 -48.39 31.33 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 122.137 -0.352 . . . . 70.5 110.84 168.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.416 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.7 pt20 -72.59 -37.33 68.19 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 112.398 0.518 . . . . 74.1 112.398 -176.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 HG23 ' A' ' 63' ' ' VAL . 79.4 t -76.52 -26.83 16.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 C-N-CA 123.121 0.569 . . . . 74.12 111.895 179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.409 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 3.8 mm? -103.26 14.36 31.78 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.927 -0.483 . . . . 71.54 111.38 175.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.9 t -77.89 -1.15 30.38 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 112.879 0.696 . . . . 53.0 112.879 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.572 ' HA ' HD11 ' A' ' 56' ' ' ILE . 0.8 OUTLIER -46.84 113.77 2.49 Favored Pre-proline 0 CA--C 1.562 1.406 0 C-N-CA 125.437 1.495 . . . . 73.24 113.052 -178.974 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' HD11 ' A' ' 56' ' ' ILE . 59.6 Cg_endo -68.53 -21.4 40.03 Favored 'Trans proline' 0 C--N 1.38 2.204 0 C-N-CA 122.599 2.199 . . . . 74.43 111.631 171.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -154.65 153.4 31.28 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.095 1.358 . . . . 71.45 108.269 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.421 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -72.55 2.32 6.59 Favored 'General case' 0 N--CA 1.494 1.773 0 N-CA-C 112.74 0.645 . . . . 73.21 112.74 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 62.1 t -55.77 -33.5 34.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 C-N-CA 124.615 1.166 . . . . 63.23 112.049 172.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.572 HD11 ' HA ' ' A' ' 51' ' ' ASP . 42.0 pt -103.54 23.81 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 C-N-CA 123.402 0.681 . . . . 71.23 112.447 -179.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttt180 -65.14 -23.22 67.07 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.371 0.668 . . . . 71.4 111.53 175.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -64.2 -54.15 38.0 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 123.633 0.773 . . . . 65.41 111.463 175.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.3 ptp180 -69.79 -20.75 63.46 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.465 0.306 . . . . 74.31 111.615 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.458 ' HG2' ' HG2' ' A' ' 27' ' ' PRO . 41.4 tttp -53.78 -41.18 66.94 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.802 1.241 . . . . 55.22 112.009 -174.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 15.8 t -75.99 -43.34 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.896 0 CA-C-N 115.789 -0.642 . . . . 52.03 110.325 176.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.7 -38.62 95.43 Favored Glycine 0 CA--C 1.538 1.505 0 O-C-N 123.419 0.45 . . . . 34.04 114.173 -177.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.524 HG23 HG22 ' A' ' 48' ' ' VAL . 32.6 m -73.3 -31.66 34.79 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.89 0 C-N-CA 123.057 0.543 . . . . 73.12 110.504 176.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.578 HD22 ' HB3' ' A' ' 27' ' ' PRO . 51.8 tp -66.19 -40.75 90.65 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 122.761 0.424 . . . . 75.04 111.177 171.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 58.8 mt -65.89 -31.12 71.87 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.012 0.525 . . . . 74.53 110.842 178.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -66.41 -35.34 80.08 Favored 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 124.823 1.249 . . . . 72.51 111.002 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.569 HD13 ' HB3' ' A' ' 44' ' ' ASP . 77.9 mt -71.36 -44.51 72.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 124.465 1.106 . . . . 74.32 111.502 173.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.653 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.1 mt -66.79 -19.36 65.73 Favored 'General case' 0 CA--C 1.567 1.616 0 CA-C-N 115.489 -0.778 . . . . 74.43 110.662 175.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.1 tm0? -79.7 -39.68 30.67 Favored 'General case' 0 CA--C 1.564 1.515 0 C-N-CA 124.221 1.008 . . . . 74.21 111.755 165.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 5.8 ptm180 -61.22 -19.7 61.96 Favored 'General case' 0 N--CA 1.51 2.572 0 C-N-CA 123.665 0.786 . . . . 71.25 112.58 -176.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p -85.98 -5.58 59.2 Favored 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 124.147 0.979 . . . . 34.32 113.544 179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.9 74.72 0.42 Allowed Glycine 0 CA--C 1.544 1.894 0 N-CA-C 114.396 0.518 . . . . 74.52 114.396 177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.505 ' O ' HG23 ' A' ' 77' ' ' VAL . 9.7 t60 80.53 -37.79 0.15 Allowed 'General case' 0 N--CA 1.502 2.134 0 C-N-CA 125.713 1.605 . . . . 75.22 112.288 177.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.422 ' HB3' HG12 ' A' ' 39' ' ' VAL . 5.4 mmmm -45.93 -60.14 2.42 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 124.48 1.112 . . . . 73.31 112.573 175.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.13 -28.22 73.43 Favored Glycine 0 C--N 1.339 0.737 0 CA-C-N 115.653 -0.703 . . . . 61.24 113.554 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.487 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 67.6 t80 -56.97 -54.79 42.65 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.136 0.574 . . . . 63.03 110.684 170.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 73' ' ' HIS . 38.6 t -55.46 -45.08 78.22 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 123.848 0.859 . . . . 52.11 110.669 176.293 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.24 -39.7 91.29 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 115.142 -0.935 . . . . 75.13 113.173 178.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.653 ' HB2' HD13 ' A' ' 68' ' ' LEU . 63.2 t80 -65.93 -44.09 86.17 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 110.209 -0.293 . . . . 72.43 110.209 176.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 60.3 mt -59.02 -51.35 70.44 Favored 'General case' 0 C--O 1.213 -0.823 0 O-C-N 123.585 0.553 . . . . 61.01 111.025 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.531 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 0.2 OUTLIER -64.3 -37.9 89.14 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 113.988 1.107 . . . . 72.11 113.988 -179.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.42 ' O ' ' HD2' ' A' ' 86' ' ' TYR . 88.6 p -63.69 -44.24 94.27 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-O 121.247 0.546 . . . . 71.42 109.804 171.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 18.9 tp -60.18 -39.58 86.99 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.904 0.882 . . . . 75.23 111.442 178.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.789 ' HB3' ' HG2' ' A' ' 101' ' ' ARG . 6.6 mm-40 -63.87 -23.96 67.56 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 113.061 0.763 . . . . 74.2 113.061 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.576 HD21 ' HG2' ' A' ' 122' ' ' GLU . 7.7 tt -88.5 -48.61 7.47 Favored 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 123.465 0.706 . . . . 73.32 110.145 175.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.42 ' HD2' ' O ' ' A' ' 82' ' ' SER . 94.8 m-85 -81.95 -60.6 2.17 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 113.694 0.998 . . . . 74.13 113.694 -175.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.458 ' HB3' HD23 ' A' ' 90' ' ' LEU . 25.3 m-85 -132.58 71.45 78.84 Favored Pre-proline 0 N--CA 1.502 2.155 0 O-C-N 121.68 -0.638 . . . . 71.13 111.888 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.655 ' HG3' HH21 ' A' ' 101' ' ' ARG . 37.4 Cg_endo -62.91 -16.52 54.44 Favored 'Trans proline' 0 C--N 1.377 2.06 0 C-N-CA 122.814 2.343 . . . . 73.31 113.335 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.01 -38.65 86.35 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.91 0.884 . . . . 71.11 111.878 170.451 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.538 HD12 HD23 ' A' ' 21' ' ' LEU . 3.6 mm? -64.98 -24.29 67.47 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 123.653 0.781 . . . . 71.42 111.39 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -43.84 21.65 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 123.433 0.693 . . . . 73.1 110.55 171.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 7.9 tmtt? -54.76 -41.03 69.98 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.204 1.001 . . . . 71.32 110.898 179.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -69.61 -42.93 73.71 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.881 0.697 . . . . 75.32 112.881 177.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.418 HG13 ' O ' ' A' ' 90' ' ' LEU . 13.4 m -69.89 -30.47 44.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 112.993 0.738 . . . . 74.02 112.993 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 67.4 p -93.73 -40.15 10.38 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 112.588 0.588 . . . . 62.14 112.588 -179.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 104.3 -20.3 40.51 Favored Glycine 0 CA--C 1.533 1.21 0 CA-C-N 116.201 -0.454 . . . . 42.33 114.219 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -121.26 -174.32 2.82 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.478 0.639 . . . . 71.11 110.935 -179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -53.7 149.2 16.83 Favored Pre-proline 0 CA--C 1.569 1.675 0 C-N-CA 124.714 1.205 . . . . 74.21 113.426 -179.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -53.27 126.29 21.14 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 123.4 2.733 . . . . 62.32 113.137 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.16 -46.41 28.71 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 123.4 0.68 . . . . 62.45 111.352 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.789 ' HG2' ' HB3' ' A' ' 84' ' ' GLU . 61.9 mtt180 58.9 54.22 5.23 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.99 1.316 . . . . 71.13 111.496 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 7.9 t -82.9 50.61 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.387 0 CA-C-N 114.528 -1.215 . . . . 74.43 109.91 -177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.531 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 38.1 m-85 -55.14 -1.98 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 114.736 1.384 . . . . 74.41 114.736 -175.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.461 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 36.6 t -55.54 -20.64 13.8 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.329 1.052 . . . . 62.55 111.44 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.481 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 13.6 tpt -56.9 -65.83 0.55 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.34 0.656 . . . . 63.44 111.039 169.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.482 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -68.34 -29.58 44.73 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.459 0.703 . . . . 63.32 111.216 -177.659 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.599 HD12 ' HG2' ' A' ' 112' ' ' GLU . 33.2 mm -62.22 -54.38 35.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 C-N-CA 123.925 0.89 . . . . 74.15 111.688 175.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -76.72 -23.21 53.07 Favored 'General case' 0 N--CA 1.485 1.275 0 N-CA-C 112.771 0.656 . . . . 70.11 112.771 178.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.35 -59.68 2.62 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 112.162 0.43 . . . . 75.42 112.162 -179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.4 p -108.66 -38.73 5.58 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.964 0.506 . . . . 33.21 112.223 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 136.88 158.8 8.09 Favored Glycine 0 N--CA 1.473 1.153 0 CA-C-N 116.718 -0.219 . . . . 70.43 113.056 -176.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.599 ' HG2' HD12 ' A' ' 107' ' ' ILE . 46.9 mt-10 -62.58 -32.87 73.93 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.259 0.624 . . . . 75.44 111.067 171.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 63.4 p -57.65 -45.52 85.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.418 1.087 . . . . 73.22 111.203 171.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.04 -53.22 43.96 Favored Glycine 0 C--N 1.354 1.564 0 O-C-N 123.698 0.624 . . . . 62.22 113.055 177.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.482 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.7 tp -65.03 -39.43 93.35 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.721 0.408 . . . . 73.44 111.715 178.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.9 m -59.2 -40.09 84.64 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.603 0.761 . . . . 73.24 111.004 177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -70.16 -43.75 70.2 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.194 0.598 . . . . 74.11 112.108 176.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.446 HD11 ' HG3' ' A' ' 36' ' ' GLN . 97.6 mt -56.35 -41.22 75.77 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.262 0.625 . . . . 61.11 110.957 174.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 67.1 mt -74.52 -40.07 61.98 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.465 1.106 . . . . 61.44 112.257 179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.24 -38.7 91.97 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.32 0.648 . . . . 72.11 109.891 -178.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 15.3 t -75.99 -37.63 58.31 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 116.468 -0.333 . . . . 70.43 111.568 172.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.576 ' HG2' HD21 ' A' ' 85' ' ' LEU . 12.5 tp10 -60.11 -35.68 75.77 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 112.678 0.622 . . . . 72.15 112.678 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 21.1 m -66.49 -24.24 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 N-CA-C 111.556 0.206 . . . . 74.53 111.556 176.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.2 mtm -82.0 -37.3 26.8 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.011 0.525 . . . . 64.33 110.0 176.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.47 ' HD3' ' HA ' ' A' ' 122' ' ' GLU . 47.7 mtpt -61.81 -39.19 90.9 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 124.519 1.128 . . . . 73.22 111.136 174.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 16.1 mt -78.41 -36.41 45.74 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.272 1.029 . . . . 73.25 111.091 176.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.8 -32.53 71.87 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 120.925 0.393 . . . . 73.23 110.563 170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 18.5 tppt? -72.03 -46.61 56.42 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.279 1.032 . . . . 44.41 110.165 175.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -61.29 -41.0 96.23 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 123.243 0.617 . . . . 73.31 112.027 178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 46.5 t -65.09 -51.35 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.947 0 C-N-CA 123.61 0.764 . . . . 62.11 110.34 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.628 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.4 pt20 -65.88 -27.99 68.62 Favored 'General case' 0 N--CA 1.482 1.154 0 O-C-N 122.304 -0.247 . . . . 73.41 111.581 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -65.08 -41.97 94.55 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.491 0.716 . . . . 54.32 110.466 175.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 12.0 mt -75.08 -43.52 52.65 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.233 -0.44 . . . . 75.35 110.624 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.628 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.1 t -67.59 -23.33 65.38 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.038 0.135 . . . . 74.54 111.125 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.12 -47.07 81.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.903 0.481 . . . . 42.54 111.289 170.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.6 ' HB2' HD11 ' B' ' 137' ' ' LEU . 36.0 mt -79.97 -19.6 47.53 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.203 0.601 . . . . 63.34 111.67 -179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 136' ' ' LEU . 3.9 tt -80.52 -61.2 2.04 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.292 1.037 . . . . 45.45 109.35 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -68.86 -24.9 64.4 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.198 0.599 . . . . 61.13 112.254 -179.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 49.2 m -124.43 84.69 2.31 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.318 0.647 . . . . 74.34 109.757 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.441 ' HG3' ' HD3' ' B' ' 140' ' ' LYS . 0.1 OUTLIER -77.54 -149.7 0.04 OUTLIER 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.007 0.923 . . . . 71.41 111.76 173.487 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . 0.407 ' H ' ' HB3' ' A' ' 140' ' ' LYS . 15.0 m-20 61.9 24.59 14.66 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.576 1.15 . . . . 62.43 110.338 -167.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.562 1.428 0 C-N-CA 125.095 1.358 . . . . 73.44 108.924 -170.989 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.246 0 CA-C-O 119.957 -0.357 . . . . 64.41 113.179 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 74.3 m -147.33 132.65 18.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.862 0.865 . . . . 74.14 110.676 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -89.73 161.04 16.26 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.686 0.794 . . . . 72.11 110.402 176.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -133.71 -48.91 0.82 Allowed 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 122.998 0.519 . . . . 75.11 111.865 179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -75.21 84.53 2.39 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.503 0.721 . . . . 72.3 112.358 -175.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 -97.94 -161.1 0.85 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.798 0.839 . . . . 64.42 109.468 173.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -84.71 42.61 0.92 Allowed 'General case' 0 CA--C 1.56 1.365 0 C-N-CA 123.464 0.706 . . . . 63.54 112.117 -178.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -62.22 -21.9 65.51 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.303 0.853 . . . . 72.04 113.303 -178.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -60.24 -20.83 60.57 Favored 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.307 1.043 . . . . 73.53 112.817 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 28.1 p -55.47 -27.93 51.37 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 124.353 1.061 . . . . 72.12 113.47 177.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.523 ' HB3' ' NH1' ' B' ' 18' ' ' ARG . 76.5 m95 -57.83 -18.87 24.86 Favored 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 113.542 0.942 . . . . 73.23 113.542 174.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . 0.439 ' HA ' ' HB2' ' B' ' 15' ' ' GLU . 50.3 m -60.37 -25.55 65.96 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.474 0.709 . . . . 63.52 112.307 173.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -66.81 -39.45 83.65 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.277 0 C-N-CA 123.401 0.68 . . . . 75.23 110.94 173.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 80' ' ' LEU . 49.8 mt -77.28 -25.88 51.81 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 119.047 -0.502 . . . . 75.22 111.894 173.403 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.439 ' HB2' ' HA ' ' B' ' 12' ' ' SER . 7.4 tp10 -43.56 -57.41 3.15 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 125.453 1.501 . . . . 75.44 113.649 -170.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.04 -28.06 57.88 Favored Glycine 0 C--N 1.35 1.306 0 O-C-N 123.73 0.644 . . . . 65.25 114.309 -178.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -101.74 -7.15 22.86 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.616 0.766 . . . . 74.53 112.595 179.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.523 ' NH1' ' HB3' ' B' ' 11' ' ' TRP . 28.6 mtm180 -66.32 -25.47 66.85 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 119.195 0.907 . . . . 61.41 112.334 -177.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 6.4 p -56.45 -38.01 54.05 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.719 0 CA-C-O 120.955 0.407 . . . . 75.42 111.411 169.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 23.2 m -79.86 -43.57 22.08 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.878 0.871 . . . . 50.45 110.984 175.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.585 HD23 HD12 ' B' ' 90' ' ' LEU . 96.4 mt -59.98 -40.09 87.93 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 123.723 0.809 . . . . 75.42 111.84 -177.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.61 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 50.7 p -71.6 -26.41 62.57 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.79 0.663 . . . . 74.33 112.79 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 34.8 t -81.51 -39.39 24.78 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.304 0.642 . . . . 62.53 112.101 176.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.46 HG11 HD21 ' B' ' 90' ' ' LEU . 92.6 t -80.76 -54.59 10.12 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 N-CA-C 113.117 0.784 . . . . 51.11 113.117 -174.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.401 ' HA ' ' CE1' ' B' ' 87' ' ' TYR . 2.3 mp -70.18 147.78 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.454 0.702 . . . . 71.23 111.929 -168.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.509 ' HB2' HH21 ' B' ' 57' ' ' ARG . 32.8 t70 -108.65 115.02 58.23 Favored Pre-proline 0 C--O 1.252 1.21 0 C-N-CA 122.826 0.451 . . . . 71.51 110.146 173.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.53 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 50.1 Cg_exo -54.99 -32.82 80.6 Favored 'Trans proline' 0 C--N 1.376 1.989 0 C-N-CA 122.62 2.213 . . . . 75.24 112.913 -178.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 47.5 t -77.76 -20.38 53.49 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 122.92 0.488 . . . . 60.45 111.593 -174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -90.39 -28.89 18.37 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.303 0.501 . . . . 72.33 110.764 178.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 34.2 pt -86.81 -18.92 8.32 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 N-CA-C 112.128 0.418 . . . . 71.22 112.128 -179.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.597 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -53.08 -50.38 82.38 Favored Pre-proline 0 N--CA 1.497 1.879 0 CA-C-O 117.801 -1.095 . . . . 74.42 113.896 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -64.02 -34.27 59.39 Favored 'Trans proline' 0 C--N 1.398 3.151 0 C-N-CA 122.132 1.888 . . . . 72.33 113.033 -178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -65.28 -52.02 57.0 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.142 0.577 . . . . 74.21 110.268 175.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.446 ' HB2' HD13 ' B' ' 40' ' ' LEU . 87.4 mt -65.84 -22.58 66.55 Favored 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.608 0.763 . . . . 71.5 112.944 -178.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -56.96 -56.26 23.97 Favored 'General case' 0 N--CA 1.492 1.63 0 CA-C-O 121.464 0.65 . . . . 61.54 109.582 169.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.439 ' HB2' HD11 ' B' ' 118' ' ' LEU . 12.2 mm100 -69.09 -24.51 64.14 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.637 -1.165 . . . . 70.3 111.647 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -72.4 -14.0 61.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 122.652 0.381 . . . . 60.21 111.868 172.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 65.12 18.36 11.42 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 124.188 0.995 . . . . 61.23 112.742 174.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.567 HG12 ' HB3' ' B' ' 74' ' ' LYS . 23.2 m -101.18 -34.99 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.85 0.86 . . . . 74.21 111.02 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.626 HD21 ' HB3' ' B' ' 45' ' ' GLU . 5.4 tt -82.15 117.03 21.99 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.13 1.372 . . . . 71.24 110.082 177.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -88.32 163.31 37.1 Favored Pre-proline 0 CA--C 1.557 1.227 0 C-N-CA 123.972 0.909 . . . . 70.21 110.498 179.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -56.96 -28.65 79.08 Favored 'Trans proline' 0 C--N 1.384 2.423 0 C-N-CA 122.706 2.271 . . . . 51.55 113.533 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -68.13 -52.61 32.8 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.985 0.914 . . . . 75.15 112.533 -177.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.729 ' HB3' HG21 ' B' ' 67' ' ' ILE . 0.6 OUTLIER -70.23 -52.83 20.18 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 116.283 -0.417 . . . . 54.02 111.649 -171.084 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.626 ' HB3' HD21 ' B' ' 40' ' ' LEU . 15.4 pt-20 -45.78 -43.32 13.04 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 112.807 0.669 . . . . 70.22 112.807 176.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -73.99 -53.81 9.26 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 118.888 -0.577 . . . . 73.52 111.476 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.447 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 10.4 pt20 -63.23 -33.8 76.28 Favored 'General case' 0 N--CA 1.502 2.158 0 N-CA-C 112.774 0.657 . . . . 75.33 112.774 -172.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.63 HG22 HG23 ' B' ' 63' ' ' VAL . 80.7 t -69.7 -24.24 26.77 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.303 0 C-N-CA 123.817 0.847 . . . . 70.14 111.429 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -114.84 14.82 17.43 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.228 0.611 . . . . 70.42 111.522 173.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 24.6 t -99.59 9.19 43.61 Favored 'General case' 0 N--CA 1.502 2.155 0 C-N-CA 123.972 0.909 . . . . 73.21 111.829 177.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.649 ' HB3' HD11 ' B' ' 56' ' ' ILE . 7.3 m-20 -67.24 161.41 64.28 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 124.122 0.969 . . . . 71.51 112.679 -179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -53.22 -33.78 66.48 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 122.867 2.378 . . . . 74.43 114.014 176.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -155.39 163.87 39.49 Favored 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 123.652 0.781 . . . . 61.14 110.144 -174.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.47 ' O ' ' HB2' ' B' ' 57' ' ' ARG . 2.5 pt? -84.24 -1.71 55.69 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.907 0.483 . . . . 71.35 111.992 170.049 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 60.0 t -58.77 -30.01 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.856 0.862 . . . . 75.11 111.666 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.649 HD11 ' HB3' ' B' ' 51' ' ' ASP . 18.8 pt -93.11 26.55 0.4 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 124.604 1.162 . . . . 64.42 112.61 177.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.614 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 56.7 ttt180 -51.58 -29.32 16.86 Favored 'General case' 0 N--CA 1.501 2.086 0 C-N-CA 125.182 1.393 . . . . 63.2 113.14 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.451 ' O ' ' HB ' ' B' ' 22' ' ' THR . 29.2 tptp -54.45 -62.41 1.67 Allowed 'General case' 0 CA--C 1.557 1.249 0 C-N-CA 124.74 1.216 . . . . 72.25 111.581 171.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.438 ' HD2' HD12 ' B' ' 56' ' ' ILE . 0.0 OUTLIER -71.48 -18.86 62.27 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.615 0.598 . . . . 50.24 112.615 -177.386 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.614 ' HD2' ' HA ' ' B' ' 57' ' ' ARG . 57.4 mttm -58.16 -52.55 65.08 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.223 0.609 . . . . 73.44 112.54 177.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.61 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 20.7 t -60.27 -39.36 80.55 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 N-CA-C 110.015 -0.365 . . . . 64.31 110.015 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.44 -43.11 99.76 Favored Glycine 0 C--N 1.348 1.236 0 O-C-N 123.774 0.672 . . . . 73.31 114.091 -179.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.63 HG23 HG22 ' B' ' 48' ' ' VAL . 17.0 m -70.75 -33.09 51.33 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 CA-C-N 117.404 0.602 . . . . 74.11 110.664 177.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 39.5 tp -66.28 -39.51 89.44 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 122.724 0.41 . . . . 71.32 111.553 174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 76.5 mt -71.59 -35.3 70.49 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 122.922 0.489 . . . . 54.2 110.652 177.182 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -62.32 -31.38 71.98 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.254 1.422 . . . . 72.41 111.184 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.729 HG21 ' HB3' ' B' ' 44' ' ' ASP . 96.1 mt -81.98 -51.7 14.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.012 0 C-N-CA 123.321 0.648 . . . . 64.02 111.376 173.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.5 mt -56.53 -19.92 17.95 Favored 'General case' 0 N--CA 1.497 1.91 0 C-N-CA 124.111 0.965 . . . . 60.31 112.399 176.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 17.0 tm0? -50.42 -41.11 51.94 Favored 'General case' 0 CA--C 1.562 1.408 0 C-N-CA 124.59 1.156 . . . . 73.42 113.096 168.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 3.8 ptm180 -63.17 -26.59 68.88 Favored 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 123.215 0.606 . . . . 74.51 112.611 -172.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.641 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 72.1 p -77.24 -3.27 38.88 Favored 'General case' 0 CA--C 1.559 1.302 0 N-CA-C 112.957 0.725 . . . . 74.33 112.957 -174.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 84.75 -60.51 4.8 Favored Glycine 0 C--N 1.35 1.356 0 N-CA-C 114.238 0.455 . . . . 31.24 114.238 175.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -149.27 -11.37 0.31 Allowed 'General case' 0 N--CA 1.478 0.97 0 O-C-N 121.359 -1.083 . . . . 73.1 111.371 178.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.641 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.2 mmmm -59.81 -61.77 2.37 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.068 0.947 . . . . 60.23 111.875 -177.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.29 85.61 Favored Glycine 0 C--N 1.344 0.979 0 CA-C-N 115.792 -0.64 . . . . 75.03 112.551 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 56.8 t80 -54.58 -65.37 0.59 Allowed 'General case' 0 CA--C 1.56 1.344 0 C-N-CA 124.851 1.26 . . . . 73.04 112.616 172.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.4 t -58.47 -44.9 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.638 0.775 . . . . 54.22 111.275 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.71 -38.93 89.69 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 115.64 -0.709 . . . . 73.2 112.675 178.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 t80 -65.24 -44.06 89.38 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 110.288 -0.264 . . . . 74.22 110.288 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.633 HD21 HD21 ' B' ' 14' ' ' LEU . 95.9 mt -60.29 -43.5 96.19 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 113.518 0.933 . . . . 64.53 113.518 179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -76.95 -31.59 56.71 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 113.956 1.095 . . . . 75.12 113.956 178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.0 p -65.06 -39.3 93.08 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.721 -0.844 . . . . 61.32 108.721 167.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.42 HD21 ' HB3' ' B' ' 90' ' ' LEU . 23.4 tp -65.81 -38.81 89.97 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 114.962 -1.017 . . . . 62.3 111.909 -178.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -56.66 -45.3 81.72 Favored 'General case' 0 N--CA 1.484 1.262 0 CA-C-N 118.364 0.529 . . . . 71.33 111.118 174.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.502 HD21 ' HG2' ' B' ' 122' ' ' GLU . 6.7 tt -64.51 -53.78 42.6 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.057 0.543 . . . . 71.22 111.074 178.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -79.79 -53.78 6.46 Favored 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 113.073 0.768 . . . . 73.25 113.073 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.584 ' HB3' HD23 ' B' ' 90' ' ' LEU . 48.4 m-85 -129.59 79.38 73.83 Favored Pre-proline 0 N--CA 1.497 1.891 0 C-N-CA 123.188 0.595 . . . . 64.1 111.578 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.24 -32.95 89.53 Favored 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.113 2.542 . . . . 74.21 113.731 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.434 ' HG3' HD22 ' B' ' 90' ' ' LEU . 13.9 pt20 -70.52 -30.28 67.0 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 112.199 0.444 . . . . 71.13 112.199 -179.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.585 HD12 HD23 ' B' ' 21' ' ' LEU . 4.4 mm? -69.63 -43.76 72.02 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.144 0.578 . . . . 52.22 111.335 175.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.437 ' CE1' ' HB3' ' B' ' 80' ' ' LEU . 10.3 t80 -64.37 -43.75 93.52 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-O 121.225 0.536 . . . . 74.4 110.275 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -53.77 -49.09 69.0 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 124.312 1.045 . . . . 72.55 112.965 174.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -71.02 -40.07 71.97 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.726 0.639 . . . . 65.4 112.726 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 21.6 m -67.25 -32.4 57.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 N-CA-C 112.189 0.44 . . . . 54.4 112.189 178.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.4 p -74.38 -42.33 59.47 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 120.591 0.234 . . . . 55.34 111.149 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.55 -9.52 61.73 Favored Glycine 0 CA--C 1.537 1.461 0 N-CA-C 114.826 0.691 . . . . 15.41 114.826 -175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.96 -162.36 1.29 Allowed 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.646 0.778 . . . . 73.23 109.693 -179.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -49.26 132.36 17.05 Favored Pre-proline 0 CA--C 1.569 1.69 0 C-N-CA 123.906 0.883 . . . . 72.23 111.647 167.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -67.45 137.54 43.32 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 122.408 2.072 . . . . 64.31 112.052 178.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.85 -42.17 73.92 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 122.469 0.307 . . . . 42.12 110.893 -179.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 59.93 52.95 4.94 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.048 0.939 . . . . 72.11 110.774 174.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 14.3 t -79.71 47.79 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.619 0 C-N-CA 125.14 1.376 . . . . 70.14 111.078 -176.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.409 ' O ' HG12 ' B' ' 107' ' ' ILE . 67.3 m-85 -54.51 -14.18 1.19 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 124.454 1.101 . . . . 71.32 113.062 177.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.402 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 41.8 t -54.47 -22.72 13.55 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.371 1.068 . . . . 75.01 111.376 171.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -55.72 -64.24 0.91 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 124.595 1.158 . . . . 74.23 111.745 172.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.41 ' O ' HD13 ' B' ' 106' ' ' ILE . 0.0 OUTLIER -71.63 -27.86 29.49 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.429 0 C-N-CA 123.277 0.631 . . . . 62.44 110.403 -178.889 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.46 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.9 mm -59.43 -55.06 26.2 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.474 0 C-N-CA 122.946 0.499 . . . . 65.34 111.162 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -68.31 -29.0 67.66 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 112.876 0.695 . . . . 64.34 112.876 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.78 -51.58 26.13 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 113.721 1.008 . . . . 65.31 113.721 -178.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 28.8 t -123.17 2.2 9.21 Favored 'General case' 0 N--CA 1.502 2.135 0 N-CA-C 112.812 0.671 . . . . 72.41 112.812 -172.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.23 160.99 36.37 Favored Glycine 0 CA--C 1.533 1.163 0 N-CA-C 112.351 -0.299 . . . . 30.43 112.351 -173.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.46 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.5 mt-10 -61.82 -35.36 78.0 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 122.625 0.37 . . . . 51.55 110.62 170.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 58.1 p -60.24 -34.7 74.06 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.253 1.021 . . . . 54.41 111.867 171.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.27 -54.78 34.44 Favored Glycine 0 C--N 1.355 1.617 0 O-C-N 123.068 0.23 . . . . 73.1 113.178 175.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 36.0 tp -64.77 -34.05 77.43 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 122.851 0.46 . . . . 74.52 111.634 175.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -59.58 -41.22 89.76 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.307 0.643 . . . . 73.05 110.825 174.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 49.0 mt-30 -71.6 -38.56 70.85 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.173 0.589 . . . . 72.04 112.169 177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 36' ' ' GLN . 82.0 mt -61.44 -43.38 98.97 Favored 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.212 0.529 . . . . 60.3 112.01 174.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.746 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 75.5 mt -70.44 -46.89 62.99 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.383 0.673 . . . . 74.35 111.077 178.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.674 ' SD ' HD21 ' A' ' 119' ' ' LEU . 39.4 mmm -57.92 -39.09 77.15 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.309 0.855 . . . . 74.41 113.309 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . 0.427 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.8 t -70.03 -42.4 72.98 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 120.126 -0.63 . . . . 70.51 110.013 174.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.502 ' HG2' HD21 ' B' ' 85' ' ' LEU . 13.7 tp10 -61.61 -32.44 72.56 Favored 'General case' 0 CA--C 1.554 1.127 0 N-CA-C 112.117 0.414 . . . . 73.43 112.117 179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.521 HG22 ' O ' ' B' ' 120' ' ' MET . 5.2 m -67.13 -28.49 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 CA-C-N 118.39 0.541 . . . . 73.42 110.647 175.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 78.3 mtm -80.95 -34.28 33.34 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.884 0.474 . . . . 65.32 110.657 179.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' B' ' 121' ' ' THR . 43.9 mtpt -61.77 -53.74 51.85 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.642 0.777 . . . . 73.04 110.218 174.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.604 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.9 mt -57.93 -42.99 86.01 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 124.686 1.194 . . . . 53.42 112.882 171.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -63.99 -41.44 97.51 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 122.649 0.379 . . . . 62.14 111.305 -179.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.42 -36.49 81.36 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.702 0.801 . . . . 74.31 110.293 175.457 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.458 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.5 tptt -66.16 -35.08 79.52 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.037 0.535 . . . . 42.42 111.712 175.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.474 HG23 ' O ' ' B' ' 126' ' ' LEU . 67.3 t -61.51 -46.51 96.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.047 0.539 . . . . 72.34 110.232 174.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.496 ' HA ' HG22 ' B' ' 134' ' ' THR . 3.8 tt0 -62.75 -40.78 98.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.595 0.758 . . . . 70.51 111.713 174.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 28.9 t70 -60.0 -36.64 77.64 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.896 0.879 . . . . 72.22 110.162 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 17.4 mt -83.89 -37.62 22.16 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 115.641 -0.709 . . . . 71.32 111.279 -177.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.496 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.3 t -68.53 -31.37 70.56 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.127 0.421 . . . . 62.33 110.694 -179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.89 -45.03 83.5 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 123.672 0.789 . . . . 74.32 110.854 176.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 137' ' ' LEU . 64.5 mt -77.76 -25.0 48.84 Favored 'General case' 0 N--CA 1.478 0.956 0 CA-C-N 115.395 -0.821 . . . . 71.32 111.767 178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.6 HD11 ' HB2' ' A' ' 136' ' ' LEU . 3.9 tt -73.05 -52.89 12.62 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.888 -0.782 . . . . 72.41 108.888 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 39.7 t -58.85 -33.25 70.23 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.01 0.924 . . . . 74.12 112.715 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 78.9 p -139.18 101.15 4.19 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.058 0.543 . . . . 70.11 110.883 -178.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.441 ' HD3' ' HG3' ' A' ' 140' ' ' LYS . 9.6 mtpm? -104.6 -51.64 3.04 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.429 0.691 . . . . 71.24 111.073 175.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 24.1 t70 81.15 -47.8 0.25 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 126.369 1.868 . . . . 51.42 111.718 -173.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 CA--C 1.571 1.752 0 C-N-CA 123.045 0.538 . . . . 72.2 112.121 -178.417 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 112.475 -0.25 . . . . 74.14 112.475 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 62.9 p -122.15 106.65 11.35 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-N 117.53 0.665 . . . . 73.52 110.752 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.3 m-20 -102.38 154.94 18.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.71 0.804 . . . . 72.41 111.889 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -73.4 -17.71 61.23 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.362 0.875 . . . . 63.31 113.362 -174.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -60.81 149.67 35.15 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.742 0.817 . . . . 54.42 112.531 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.419 HD22 ' N ' ' A' ' 6' ' ' ASN . 0.8 OUTLIER -92.88 39.28 1.04 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 123.973 0.909 . . . . 72.04 110.747 178.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -72.1 133.91 45.48 Favored 'General case' 0 CA--C 1.565 1.533 0 CA-C-O 121.617 0.722 . . . . 73.33 112.834 -173.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.439 ' HA ' ' HA2' ' A' ' 72' ' ' GLY . 3.7 m-20 -81.0 -22.84 39.12 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.632 0.773 . . . . 74.54 112.853 -172.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -73.74 -20.09 60.61 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.414 0.894 . . . . 64.43 113.414 -169.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.0 m -55.41 -30.98 61.45 Favored 'General case' 0 N--CA 1.498 1.965 0 C-N-CA 122.881 0.472 . . . . 71.05 112.161 173.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 64.0 m95 -61.76 -20.4 63.51 Favored 'General case' 0 N--CA 1.48 1.058 0 N-CA-C 115.01 1.485 . . . . 75.1 115.01 176.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 37.5 m -58.38 -29.03 65.71 Favored 'General case' 0 N--CA 1.499 1.99 0 CA-C-N 118.48 0.582 . . . . 63.21 112.449 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -66.29 -61.56 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 123.378 0.671 . . . . 74.31 110.479 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.0 mt -57.93 -32.01 67.36 Favored 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.85 0.86 . . . . 72.25 112.044 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.638 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 26.5 tt0 -63.36 -40.54 97.53 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.651 0.78 . . . . 72.43 111.822 179.3 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -64.05 -8.08 27.45 Favored Glycine 0 CA--C 1.541 1.696 0 CA-C-N 116.047 -0.524 . . . . 74.12 114.19 173.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -120.76 16.69 11.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.657 0.783 . . . . 71.22 111.958 175.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.638 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 68.4 mtt180 -53.82 -44.24 70.07 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 118.25 0.477 . . . . 61.45 112.177 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 8.2 p -50.52 -33.94 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 112.696 0.628 . . . . 64.01 112.696 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -87.83 -50.06 6.7 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.459 0.704 . . . . 51.5 111.898 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 25' ' ' ILE . 97.7 mt -59.51 -32.76 70.58 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.763 0.825 . . . . 63.34 112.57 -178.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.588 HG22 ' HB ' ' A' ' 61' ' ' VAL . 72.3 p -84.55 -17.64 38.23 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.077 0.551 . . . . 74.21 112.298 -179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.597 ' HB2' ' HE2' ' A' ' 58' ' ' LYS . 41.8 t -79.38 -48.16 14.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.136 0.574 . . . . 71.13 111.01 173.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.495 HG11 HD21 ' A' ' 90' ' ' LEU . 81.5 t -84.99 -53.89 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.21 0 N-CA-C 112.748 0.647 . . . . 73.13 112.748 -174.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.421 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.1 mp -77.17 139.45 18.71 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 122.833 0.453 . . . . 73.41 110.083 -173.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 7.2 p-10 -119.38 130.35 24.89 Favored Pre-proline 0 C--O 1.265 1.884 0 C-N-CA 123.023 0.529 . . . . 72.35 110.173 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.503 ' HD3' HG22 ' A' ' 61' ' ' VAL . 2.3 Cg_endo -76.0 16.57 0.8 Allowed 'Trans proline' 0 C--N 1.381 2.27 0 C-N-CA 123.024 2.483 . . . . 65.41 111.865 -178.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.6 t -88.07 -40.23 13.98 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.301 0.64 . . . . 62.52 109.438 169.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.5 ptm180 -94.17 -27.65 16.09 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 112.978 0.733 . . . . 75.22 112.978 -171.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.7 HD11 HD21 ' A' ' 64' ' ' LEU . 34.1 pt -90.55 -20.73 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 112.735 0.643 . . . . 72.12 112.735 -175.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.62 HG22 HD11 ' A' ' 40' ' ' LEU . 1.8 p -56.76 -41.21 90.14 Favored Pre-proline 0 CA--C 1.561 1.379 0 CA-C-O 117.353 -1.308 . . . . 51.3 113.507 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 12.8 Cg_endo -55.34 -40.81 83.61 Favored 'Trans proline' 0 C--N 1.394 2.929 0 C-N-CA 122.316 2.011 . . . . 64.4 113.555 171.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.95 -51.27 67.54 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.789 0.328 . . . . 71.14 110.251 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -64.37 -27.04 68.74 Favored 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.618 -0.719 . . . . 74.13 112.415 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.0 mmm180 -60.31 -57.54 12.34 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.869 0.867 . . . . 64.22 109.652 171.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.8 -22.83 66.59 Favored 'General case' 0 CA--C 1.559 1.327 0 C-N-CA 123.503 0.721 . . . . 72.24 112.261 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 90.3 m -76.59 -12.37 60.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.035 0.534 . . . . 74.01 112.438 174.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 68.43 7.39 5.96 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 124.912 1.285 . . . . 73.31 112.479 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.431 HG12 ' HB3' ' A' ' 74' ' ' LYS . 23.6 m -91.57 5.39 6.08 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 C-N-CA 123.826 0.85 . . . . 63.51 112.215 -175.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.62 HD11 HG22 ' A' ' 31' ' ' THR . 10.1 tt -129.68 116.02 18.2 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.924 0.89 . . . . 75.12 109.191 -170.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.17 153.09 68.96 Favored Pre-proline 0 CA--C 1.552 1.055 0 C-N-CA 123.314 0.646 . . . . 72.34 110.71 174.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -52.09 -20.49 10.76 Favored 'Trans proline' 0 C--N 1.39 2.737 0 C-N-CA 123.606 2.871 . . . . 54.23 114.246 -179.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -60.59 -47.92 84.08 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.213 1.005 . . . . 73.22 112.033 177.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.603 ' HB2' HG21 ' A' ' 67' ' ' ILE . 18.1 t70 -63.57 -65.43 0.68 Allowed 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.286 0.634 . . . . 74.43 111.211 -171.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -47.08 -32.29 4.02 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 124.814 1.321 . . . . 71.35 113.11 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -76.33 -53.24 8.47 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 122.876 0.47 . . . . 70.5 111.492 174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.658 ' NE2' HG13 ' A' ' 48' ' ' VAL . 1.5 pp0? -69.12 -21.29 64.04 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 113.983 1.105 . . . . 74.1 113.983 -173.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.667 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 1.6 m -78.8 -34.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 CA-C-N 118.222 0.465 . . . . 74.12 112.047 171.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -104.53 24.44 11.68 Favored 'General case' 0 N--CA 1.501 2.115 0 C-N-CA 123.29 0.636 . . . . 71.54 111.496 178.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.2 t -97.65 0.6 47.48 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 123.622 0.769 . . . . 53.0 111.974 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -107.51 132.89 20.65 Favored Pre-proline 0 CA--C 1.551 1.014 0 C-N-CA 123.907 0.883 . . . . 73.24 111.455 -171.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -82.38 11.23 3.25 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 123.119 2.546 . . . . 74.43 113.811 -176.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.594 ' HB3' HG23 ' A' ' 55' ' ' VAL . 18.3 m120 -144.15 139.84 29.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.408 0.683 . . . . 71.45 110.744 -177.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.471 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -80.19 1.16 29.37 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 123.626 0.77 . . . . 73.21 112.18 167.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.594 HG23 ' HB3' ' A' ' 53' ' ' ASN . 77.1 t -55.95 -43.32 74.55 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.514 0.726 . . . . 63.23 112.21 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 36.3 pt -93.82 23.82 0.6 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.436 0 C-N-CA 123.74 0.816 . . . . 71.23 112.958 -178.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 31.2 ptt180 -57.24 -29.63 63.94 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 113.388 0.885 . . . . 71.4 113.388 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.597 ' HE2' ' HB2' ' A' ' 23' ' ' SER . 1.6 mmmp? -74.87 -32.23 61.82 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.973 0.509 . . . . 65.41 112.188 -175.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.7 ptp180 -86.85 -20.0 28.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 122.062 -0.399 . . . . 74.31 111.546 168.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 48' ' ' VAL . 14.5 tppt? -70.58 -52.43 21.65 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.71 0.804 . . . . 55.22 112.663 -173.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.588 ' HB ' HG22 ' A' ' 22' ' ' THR . 12.9 t -69.17 -24.19 27.74 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.297 0 N-CA-C 109.467 -0.568 . . . . 52.03 109.467 174.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.78 -42.68 92.94 Favored Glycine 0 C--N 1.358 1.77 0 CA-C-N 116.035 -0.529 . . . . 34.04 113.669 174.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 34.0 m -71.15 -31.24 43.83 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 CA-C-N 117.328 0.564 . . . . 73.12 110.522 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.7 HD21 HD11 ' A' ' 30' ' ' ILE . 11.1 tp -55.46 -51.93 65.29 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.309 1.044 . . . . 75.04 111.37 168.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.522 HD12 ' HG2' ' A' ' 18' ' ' ARG . 59.2 mt -58.71 -35.44 72.67 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.973 0.509 . . . . 74.53 111.435 179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.85 -40.09 95.76 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.528 0.731 . . . . 72.51 112.254 172.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.603 HG21 ' HB2' ' A' ' 44' ' ' ASP . 69.5 mt -72.58 -31.35 37.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 CA-C-O 121.053 0.454 . . . . 74.32 111.299 179.085 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 86.8 mt -78.73 -21.92 47.31 Favored 'General case' 0 CA--C 1.56 1.327 0 C-N-CA 122.919 0.488 . . . . 74.43 110.642 173.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -75.11 -25.4 58.46 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.344 0.658 . . . . 74.21 110.945 170.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -64.51 -25.0 67.8 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.268 0.627 . . . . 71.25 112.452 174.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.463 HG23 ' H ' ' A' ' 75' ' ' GLY . 9.7 t -100.18 4.35 44.32 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.107 0.479 . . . . 34.32 111.107 173.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.439 ' HA2' ' HA ' ' A' ' 8' ' ' ASP . . . 69.79 -134.19 25.59 Favored Glycine 0 C--N 1.349 1.266 0 N-CA-C 115.889 1.115 . . . . 74.52 115.889 177.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.5 t60 -69.01 -20.45 64.15 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.841 1.256 . . . . 75.22 110.407 -174.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.431 ' HB3' HG12 ' A' ' 39' ' ' VAL . 12.0 mmmm -51.56 -62.58 1.54 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.06 0.944 . . . . 73.31 111.397 169.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.463 ' H ' HG23 ' A' ' 71' ' ' THR . . . -61.43 -35.4 90.97 Favored Glycine 0 C--N 1.346 1.099 0 CA-C-N 115.448 -0.797 . . . . 61.24 112.69 179.617 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.482 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 78.7 t80 -53.89 -64.02 0.96 Allowed 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.984 0.914 . . . . 63.03 112.229 174.101 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 78.9 t -57.95 -44.61 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.988 0 C-N-CA 123.477 0.711 . . . . 52.11 111.787 179.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.65 -41.76 74.06 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 115.48 -0.782 . . . . 75.13 111.683 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -71.83 -38.9 70.1 Favored 'General case' 0 CA--C 1.551 1.005 0 CA-C-O 118.953 -0.546 . . . . 72.43 111.44 178.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 58.0 mt -59.26 -53.08 62.32 Favored 'General case' 0 N--CA 1.495 1.819 0 CA-C-N 118.256 0.48 . . . . 61.01 111.894 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -72.86 -28.54 62.57 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.801 0.841 . . . . 72.11 111.501 -178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.5 t -61.3 -49.92 75.08 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.114 0.566 . . . . 71.42 110.032 166.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 17.8 tp -64.72 -39.13 93.12 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.043 -0.981 . . . . 75.23 110.831 -174.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.628 ' HG3' ' HG3' ' A' ' 99' ' ' PRO . 22.0 mm-40 -60.56 -24.78 65.68 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 113.047 0.758 . . . . 74.2 113.047 176.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 8.6 tt -88.08 -48.7 7.54 Favored 'General case' 0 CA--C 1.563 1.444 0 C-N-CA 123.627 0.771 . . . . 73.32 110.427 176.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.2 m-85 -82.28 -60.17 2.3 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 113.39 0.885 . . . . 74.13 113.39 -176.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -131.63 70.15 81.38 Favored Pre-proline 0 N--CA 1.505 2.291 0 C-N-CA 123.23 0.612 . . . . 71.13 111.366 -177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.422 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 17.8 Cg_endo -58.94 -31.24 95.19 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.905 2.403 . . . . 73.31 115.0 -174.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -65.16 -33.04 75.08 Favored 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 122.533 0.333 . . . . 71.11 111.377 177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.495 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -61.12 -39.09 88.72 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.63 0.772 . . . . 71.42 110.991 174.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.48 ' HA ' HG22 ' A' ' 94' ' ' VAL . 85.3 t80 -66.68 -45.83 77.57 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-O 120.735 0.303 . . . . 73.1 110.557 173.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.546 ' HE3' ' HG2' ' A' ' 98' ' ' GLU . 45.3 mmtm -58.94 -31.96 69.17 Favored 'General case' 0 N--CA 1.482 1.128 0 CA-C-N 115.906 -0.588 . . . . 71.32 112.393 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -83.91 -39.69 19.49 Favored 'General case' 0 CA--C 1.559 1.29 0 N-CA-C 112.864 0.69 . . . . 75.32 112.864 176.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.571 HG23 HG23 ' A' ' 95' ' ' THR . 18.4 m -65.71 -29.85 48.28 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 113.227 0.825 . . . . 74.02 113.227 176.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.571 HG23 HG23 ' A' ' 94' ' ' VAL . 63.6 p -108.47 -45.29 3.91 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 112.481 0.548 . . . . 62.14 112.481 -177.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 97.21 -4.37 62.45 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-N 115.951 -0.568 . . . . 42.33 113.407 -172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -141.5 177.97 7.76 Favored 'General case' 0 N--CA 1.49 1.552 0 CA-C-N 117.742 0.771 . . . . 71.11 112.097 -176.386 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.546 ' HG2' ' HE3' ' A' ' 92' ' ' LYS . 38.7 mt-10 -87.1 150.31 49.42 Favored Pre-proline 0 CA--C 1.564 1.503 0 C-N-CA 124.173 0.989 . . . . 74.21 110.363 172.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.628 ' HG3' ' HG3' ' A' ' 84' ' ' GLU . 76.9 Cg_endo -75.45 177.19 8.98 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.417 2.078 . . . . 62.32 112.558 -174.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.27 -16.48 63.98 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 122.815 0.446 . . . . 62.45 111.343 169.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 30.3 mtm180 74.78 49.9 0.09 Allowed 'General case' 0 C--N 1.364 1.21 0 C-N-CA 125.75 1.62 . . . . 71.13 109.0 -179.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 5.3 t -79.63 46.02 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.563 1.46 0 C-N-CA 124.356 1.063 . . . . 74.43 111.404 -177.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.431 ' O ' HD13 ' A' ' 107' ' ' ILE . 97.6 m-85 -59.15 -16.21 18.72 Favored 'General case' 0 CA--C 1.56 1.341 0 O-C-N 121.307 -0.871 . . . . 74.41 111.618 167.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.631 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 70.7 m -62.43 -15.26 48.33 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.378 0.671 . . . . 62.55 111.973 173.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 8.2 tpt -58.9 -62.72 1.67 Allowed 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.407 1.083 . . . . 63.44 111.463 170.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.4 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -71.87 -30.94 39.22 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.567 0 C-N-CA 123.369 0.667 . . . . 63.32 110.405 -179.551 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.694 HG13 ' HG2' ' A' ' 112' ' ' GLU . 1.3 mp -58.39 -44.84 89.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 C-N-CA 123.904 0.881 . . . . 74.15 111.419 172.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.75 -43.7 68.28 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 122.841 0.456 . . . . 70.11 112.072 173.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.43 -61.14 2.41 Favored 'General case' 0 CA--C 1.557 1.237 0 N-CA-C 113.419 0.896 . . . . 75.42 113.419 -172.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.2 t -103.92 -36.59 7.73 Favored 'General case' 0 N--CA 1.495 1.798 0 C-N-CA 123.224 0.61 . . . . 33.21 111.209 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.02 161.09 9.94 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-N 115.451 -0.795 . . . . 70.43 111.836 -173.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.694 ' HG2' HG13 ' A' ' 107' ' ' ILE . 38.7 mt-10 -60.52 -33.85 73.24 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.098 0.559 . . . . 75.44 110.159 171.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.462 ' O ' ' HG2' ' A' ' 117' ' ' GLN . 86.8 p -60.8 -39.35 88.59 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.452 1.101 . . . . 73.22 111.447 172.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.7 -53.04 46.83 Favored Glycine 0 C--N 1.356 1.655 0 O-C-N 123.415 0.447 . . . . 62.22 113.596 176.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.4 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.3 tp -64.33 -35.5 81.06 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 122.719 0.407 . . . . 73.44 111.411 175.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 53.9 m -57.12 -39.86 75.93 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.23 0.612 . . . . 73.24 111.183 172.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 113' ' ' SER . 28.3 mm-40 -71.46 -42.02 68.67 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.174 0.435 . . . . 74.11 112.174 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 95.0 mt -57.45 -44.39 84.71 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-O 121.776 0.798 . . . . 61.11 111.803 175.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 57.8 mt -69.89 -44.48 69.66 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 115.007 -0.997 . . . . 61.44 111.407 177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.68 -37.78 71.33 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 123.919 0.888 . . . . 72.11 113.104 175.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.5 t -78.95 -38.89 35.96 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 122.081 -0.387 . . . . 70.43 111.694 175.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 17.9 tp10 -61.83 -37.41 84.35 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 111.833 0.309 . . . . 72.15 111.833 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 25.3 m -63.57 -26.71 41.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.354 175.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.2 mtm -79.69 -42.48 24.62 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 110.108 -0.33 . . . . 64.33 110.108 179.66 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -57.81 -52.35 65.84 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.003 0.521 . . . . 73.22 111.198 173.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 41.8 mt -56.71 -37.07 70.43 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.358 1.063 . . . . 73.25 112.791 170.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -62.45 -42.27 99.35 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 122.59 0.356 . . . . 73.23 111.911 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -73.76 -35.08 64.96 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-O 120.382 0.134 . . . . 44.41 110.945 174.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.546 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -59.94 -42.27 93.63 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.597 0.759 . . . . 73.31 110.939 177.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 53.6 t -62.06 -52.61 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.466 0.706 . . . . 62.11 110.869 176.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.646 ' HA ' HG22 ' A' ' 134' ' ' THR . 10.8 pt20 -66.17 -28.68 68.96 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 111.649 0.24 . . . . 73.41 111.649 -177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -65.37 -39.42 92.26 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.566 0.747 . . . . 54.32 110.601 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.4 mt -79.79 -43.08 23.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.683 -0.69 . . . . 75.35 110.455 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.646 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.5 t -66.9 -26.64 66.97 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 122.232 0.213 . . . . 74.54 111.362 177.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.59 -46.24 89.53 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 121.581 0.705 . . . . 42.54 111.029 171.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.722 ' HB2' HD11 ' B' ' 137' ' ' LEU . 33.7 mt -87.66 -13.11 43.5 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.061 -0.972 . . . . 63.34 111.839 -178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.2 tt -83.58 -59.67 2.37 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 109.111 -0.7 . . . . 45.45 109.111 176.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.6 t -60.23 -30.7 69.58 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.927 0.891 . . . . 61.13 112.455 178.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.2 t -128.23 86.77 2.5 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 108.239 -1.023 . . . . 74.34 108.239 172.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' B' ' 140' ' ' LYS . 54.2 tttm -85.86 158.41 19.96 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 112.237 0.458 . . . . 71.41 112.237 -173.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -66.29 -42.45 88.38 Favored 'General case' 0 CA--C 1.555 1.16 0 C-N-CA 124.35 1.06 . . . . 62.43 112.122 -177.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 . . . . . 0 CA--C 1.563 1.46 0 C-N-CA 123.471 0.708 . . . . 73.44 110.734 172.35 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.212 0 CA-C-O 120.085 -0.286 . . . . 64.41 112.701 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.1 t -152.98 164.99 36.94 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.786 0.835 . . . . 74.14 110.804 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -155.43 150.06 26.27 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.025 0.93 . . . . 72.11 111.142 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -86.7 -29.11 22.68 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.388 0.885 . . . . 75.11 113.388 -172.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -72.76 152.37 41.64 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 118.115 0.416 . . . . 72.3 110.166 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.451 ' ND2' ' HG3' ' B' ' 74' ' ' LYS . 9.5 m120 -69.43 -93.02 0.01 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 CA-C-O 118.451 -0.785 . . . . 64.42 111.348 -176.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 61.99 148.08 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.941 0 N-CA-C 114.841 1.423 . . . . 63.54 114.841 173.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -80.84 -35.2 33.12 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 124.418 1.087 . . . . 72.04 113.658 -167.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -55.62 -34.74 65.17 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 114.542 1.312 . . . . 73.53 114.542 -164.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 84.7 m -59.65 -33.57 71.7 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 112.509 0.559 . . . . 72.12 112.509 178.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 30.7 m95 -54.86 -17.95 4.25 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 114.497 1.295 . . . . 73.23 114.497 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 62.6 m -57.34 -28.86 63.5 Favored 'General case' 0 N--CA 1.5 2.071 0 N-CA-C 112.924 0.712 . . . . 63.52 112.924 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 79.2 t -60.43 -45.26 97.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.853 0.861 . . . . 75.23 111.112 172.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 86.5 mt -78.31 -30.26 48.2 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.352 0.661 . . . . 75.22 111.802 176.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.598 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 34.3 tt0 -55.88 -50.17 71.38 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.174 0.989 . . . . 75.44 112.933 -173.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.15 -23.25 52.02 Favored Glycine 0 CA--C 1.537 1.44 0 O-C-N 123.773 0.67 . . . . 65.25 114.101 176.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -105.03 1.8 28.93 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-O 117.964 -1.017 . . . . 74.53 112.676 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.598 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 77.3 mtm180 -55.53 -36.25 66.54 Favored 'General case' 0 N--CA 1.503 2.222 0 CA-C-N 119.406 1.003 . . . . 61.41 112.846 -176.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 8.8 p -55.53 -32.75 31.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 C-N-CA 123.619 0.767 . . . . 75.42 112.155 176.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.5 m -87.83 -44.35 11.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.841 0.856 . . . . 50.45 111.295 176.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -58.2 -34.06 69.97 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.849 0.86 . . . . 75.42 111.905 -178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 76.5 p -78.27 -22.18 48.7 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.479 0.712 . . . . 74.33 112.805 178.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 35.1 t -90.76 -24.76 20.26 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.285 0.634 . . . . 62.53 112.439 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.406 ' HB ' HD12 ' B' ' 25' ' ' ILE . 90.3 t -98.29 -58.06 4.07 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 N-CA-C 112.709 0.633 . . . . 51.11 112.709 -178.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.652 HG12 HD11 ' B' ' 83' ' ' LEU . 2.8 mp -78.42 132.41 32.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 123.127 0.571 . . . . 71.23 110.361 -172.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -109.9 126.48 28.96 Favored Pre-proline 0 N--CA 1.483 1.195 0 CA-C-O 118.977 -0.535 . . . . 71.51 111.406 -175.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.822 ' HD3' HG22 ' B' ' 61' ' ' VAL . 81.5 Cg_exo -49.37 -33.07 28.04 Favored 'Trans proline' 0 C--N 1.395 3.012 0 C-N-CA 123.495 2.796 . . . . 75.24 112.843 175.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 41.3 t -64.06 -35.87 82.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.133 0.573 . . . . 60.45 111.477 -175.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.33 -21.38 19.02 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 113.178 0.807 . . . . 72.33 113.178 -172.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 47.9 pt -102.68 -18.13 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.618 0 N-CA-C 113.603 0.964 . . . . 71.22 113.603 -174.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 3.2 p -54.72 -49.61 90.51 Favored Pre-proline 0 N--CA 1.495 1.822 0 N-CA-C 114.851 1.426 . . . . 74.42 114.851 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.72 -24.35 21.7 Favored 'Trans proline' 0 C--N 1.394 2.972 0 CA-C-N 121.814 1.684 . . . . 72.33 112.872 179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.98 -53.27 52.71 Favored 'General case' 0 N--CA 1.485 1.288 0 N-CA-C 109.671 -0.492 . . . . 74.21 109.671 171.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.62 -27.39 69.17 Favored 'General case' 0 CA--C 1.564 1.505 0 C-N-CA 124.255 1.022 . . . . 71.5 112.652 178.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 35.3 mmm-85 -59.45 -53.05 62.57 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 123.324 0.65 . . . . 61.54 110.845 171.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -66.89 -27.65 67.68 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.615 0.766 . . . . 70.3 111.486 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 71.2 m -75.0 -8.29 56.1 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.394 0.678 . . . . 60.21 111.779 172.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.475 ' HA ' ' HE2' ' B' ' 38' ' ' LYS . 10.1 mmpt? 69.77 14.33 8.07 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.904 1.281 . . . . 61.23 113.223 172.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.509 ' HB ' HG21 ' B' ' 71' ' ' THR . 32.7 m -96.78 -34.43 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.083 0 C-N-CA 123.518 0.727 . . . . 74.21 111.976 -179.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.56 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.4 tt -98.17 132.27 43.83 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.117 0.967 . . . . 71.24 110.455 178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -89.09 156.82 48.85 Favored Pre-proline 0 N--CA 1.481 1.096 0 C-N-CA 123.889 0.875 . . . . 70.21 111.575 178.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -54.77 -18.96 17.39 Favored 'Trans proline' 0 C--N 1.384 2.429 0 C-N-CA 123.4 2.733 . . . . 51.55 113.74 173.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -85.39 -33.43 21.98 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.391 0.676 . . . . 75.15 112.216 176.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.498 ' O ' HG22 ' B' ' 48' ' ' VAL . 63.2 m-20 -65.27 -52.99 50.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.477 0.311 . . . . 54.02 111.298 179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.56 ' HB3' HD21 ' B' ' 40' ' ' LEU . 11.0 pt-20 -49.51 -34.91 18.4 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 113.021 0.749 . . . . 70.22 113.021 173.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 37.1 mm-40 -69.36 -53.04 21.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.123 0.569 . . . . 73.52 111.394 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.43 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 13.8 pt20 -68.17 -34.06 75.61 Favored 'General case' 0 N--CA 1.485 1.291 0 N-CA-C 113.216 0.821 . . . . 75.33 113.216 -173.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 44' ' ' ASP . 16.6 m -79.05 -9.05 12.06 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 112.939 0.718 . . . . 70.14 112.939 176.043 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -112.2 0.85 15.95 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 124.026 0.93 . . . . 70.42 111.469 172.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.1 t -80.7 -0.43 38.31 Favored 'General case' 0 N--CA 1.501 2.106 0 C-N-CA 123.962 0.905 . . . . 73.21 112.643 -176.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.452 ' HB2' HD11 ' B' ' 56' ' ' ILE . 2.6 p-10 -80.58 144.72 57.27 Favored Pre-proline 0 CA--C 1.558 1.261 0 C-N-CA 123.733 0.813 . . . . 71.51 111.344 -175.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -80.24 -6.77 13.95 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.902 2.401 . . . . 74.43 113.951 -178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -147.13 135.35 21.61 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.312 0.645 . . . . 61.14 109.848 -173.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.559 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.0 pt? -78.38 1.54 21.65 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.972 0.509 . . . . 71.35 111.517 172.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 38.9 t -65.72 -41.28 90.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.236 1.014 . . . . 75.11 110.953 177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.452 HD11 ' HB2' ' B' ' 51' ' ' ASP . 37.9 pt -84.96 17.57 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 CA-C-N 115.73 -0.668 . . . . 64.42 112.634 -179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.542 ' O ' HG23 ' B' ' 61' ' ' VAL . 27.5 ptt85 -60.39 -26.37 66.61 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 122.751 0.421 . . . . 63.2 111.919 179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -61.85 -45.33 94.25 Favored 'General case' 0 CA--C 1.555 1.155 0 C-N-CA 123.32 0.648 . . . . 72.25 111.399 178.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -79.82 -25.11 40.94 Favored 'General case' 0 N--CA 1.484 1.263 0 O-C-N 121.78 -0.575 . . . . 50.24 111.667 173.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.475 ' HE2' ' HA ' ' B' ' 48' ' ' VAL . 10.4 tptm -78.84 -27.65 44.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.073 0.549 . . . . 73.44 112.309 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.822 HG22 ' HD3' ' B' ' 27' ' ' PRO . 22.0 t -76.24 -40.07 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 N-CA-C 109.018 -0.734 . . . . 64.31 109.018 167.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.98 -37.57 91.6 Favored Glycine 0 C--N 1.353 1.525 0 O-C-N 123.662 0.601 . . . . 73.31 114.068 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.429 ' O ' HG13 ' B' ' 67' ' ' ILE . 33.3 m -73.63 -31.78 33.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 122.141 0.177 . . . . 74.11 110.797 175.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.464 ' HA ' HD12 ' B' ' 67' ' ' ILE . 54.1 tp -70.34 -33.71 71.79 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.33 0.652 . . . . 71.32 111.634 175.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 90.3 mt -65.98 -40.21 91.03 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.01 0.524 . . . . 54.2 110.059 175.026 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -60.41 -38.71 84.91 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 124.449 1.1 . . . . 72.41 111.538 171.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.464 HD12 ' HA ' ' B' ' 64' ' ' LEU . 89.3 mt -61.6 -48.52 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 123.859 0.864 . . . . 64.02 111.171 174.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.6 mt -72.8 -20.38 61.16 Favored 'General case' 0 CA--C 1.565 1.527 0 C-N-CA 123.242 0.617 . . . . 60.31 111.534 178.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -27.42 61.6 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.103 0.961 . . . . 73.42 111.668 170.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 -62.57 -32.26 73.21 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.145 0.498 . . . . 74.51 111.603 175.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.509 HG21 ' HB ' ' B' ' 39' ' ' VAL . 5.2 t -96.92 13.02 30.25 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.629 0.772 . . . . 74.33 111.243 176.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 56.12 -123.55 31.45 Favored Glycine 0 C--N 1.355 1.603 0 N-CA-C 116.057 1.183 . . . . 31.24 116.057 173.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -72.3 -22.52 61.18 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 123.682 0.793 . . . . 73.1 110.547 -173.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.451 ' HG3' ' ND2' ' B' ' 6' ' ' ASN . 33.3 mtmm -65.48 -52.95 49.21 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.101 0.41 . . . . 60.23 111.524 175.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.1 -34.06 88.74 Favored Glycine 0 N--CA 1.48 1.568 0 CA-C-N 116.505 -0.316 . . . . 75.03 113.329 175.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -52.13 -60.37 3.28 Favored 'General case' 0 CA--C 1.556 1.176 0 C-N-CA 124.495 1.118 . . . . 73.04 111.607 169.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.62 -42.67 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.967 0 C-N-CA 123.773 0.829 . . . . 54.22 111.931 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.2 -43.89 87.84 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.014 0.525 . . . . 73.2 111.384 179.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . 0.473 ' O ' HD13 ' B' ' 83' ' ' LEU . 69.9 t80 -69.04 -45.94 69.17 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.881 0.473 . . . . 74.22 110.898 176.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.419 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 82.5 mt -52.8 -51.17 61.86 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.019 0.928 . . . . 64.53 112.35 178.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.532 ' HA ' ' HB2' ' B' ' 84' ' ' GLU . 28.4 mm-40 -83.06 -20.79 34.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.452 -0.794 . . . . 75.12 111.673 -176.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . 0.434 ' O ' ' HD2' ' B' ' 86' ' ' TYR . 33.3 t -60.8 -42.36 97.44 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 109.687 -0.486 . . . . 61.32 109.687 162.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.652 HD11 HG12 ' B' ' 25' ' ' ILE . 8.5 mp -67.81 -40.35 83.86 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 119.148 -0.453 . . . . 62.3 111.075 174.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.532 ' HB2' ' HA ' ' B' ' 81' ' ' GLU . 0.5 OUTLIER -50.11 -41.12 47.89 Favored 'General case' 0 CA--C 1.571 1.755 0 CA-C-O 121.169 0.509 . . . . 71.33 110.373 177.384 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.4 tt -78.57 -62.59 1.64 Allowed 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 123.374 0.67 . . . . 71.22 111.006 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . 0.434 ' HD2' ' O ' ' B' ' 82' ' ' SER . 89.3 m-85 -77.94 -48.0 17.31 Favored 'General case' 0 N--CA 1.497 1.883 0 N-CA-C 113.983 1.105 . . . . 73.25 113.983 -169.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.485 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.7 m-85 -131.28 69.54 82.08 Favored Pre-proline 0 N--CA 1.503 2.199 0 C-N-CA 123.08 0.552 . . . . 64.1 111.455 -179.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -58.75 -28.69 87.5 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.804 2.336 . . . . 74.21 114.525 -171.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -71.36 -31.39 67.29 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.902 0.481 . . . . 71.13 111.885 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' B' ' 87' ' ' TYR . 4.4 mm? -66.58 -41.81 87.95 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.162 0.585 . . . . 52.22 110.9 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.601 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 89.0 t80 -61.98 -49.94 74.07 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 121.166 0.508 . . . . 74.4 110.44 171.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -55.91 -36.81 68.11 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 124.111 0.964 . . . . 72.55 112.775 -179.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.423 ' HD3' HD13 ' B' ' 90' ' ' LEU . 20.6 ptmt -81.31 -36.28 29.97 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 113.074 0.768 . . . . 65.4 113.074 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.438 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.1 m -67.52 -37.31 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 CA-C-N 119.017 0.826 . . . . 54.4 111.471 176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 61.0 p -88.98 -39.97 13.34 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.612 0.597 . . . . 55.34 112.612 -177.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 79.36 9.74 86.65 Favored Glycine 0 CA--C 1.537 1.459 0 CA-C-N 116.471 -0.331 . . . . 15.41 113.522 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.67 171.6 14.0 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.905 0.882 . . . . 73.23 111.195 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -58.48 139.6 85.04 Favored Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 123.312 0.645 . . . . 72.23 112.42 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.601 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 15.7 Cg_exo -39.39 117.36 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 123.89 3.06 . . . . 64.31 115.236 172.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.09 -41.23 95.2 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 116.018 -0.537 . . . . 42.12 111.029 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 85.8 mtm180 67.26 46.25 1.5 Allowed 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 113.955 -1.475 . . . . 72.11 109.289 174.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.6 t -76.69 46.11 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.561 1.398 0 C-N-CA 124.965 1.306 . . . . 70.14 111.236 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.491 ' O ' HG12 ' B' ' 107' ' ' ILE . 29.4 m-85 -65.66 -13.14 58.57 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.632 0.773 . . . . 71.32 111.315 173.054 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.412 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 73.2 m -62.34 -19.93 63.85 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.147 0.579 . . . . 75.01 111.192 172.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 12.7 tpt -56.28 -62.02 2.0 Allowed 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.579 1.151 . . . . 74.23 111.355 168.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.555 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.51 -32.19 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.574 0 C-N-CA 123.287 0.635 . . . . 62.44 110.768 -178.793 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 112' ' ' GLU . 47.0 mm -59.36 -45.94 92.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 123.744 0.817 . . . . 65.34 111.216 172.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.49 -37.4 71.28 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.317 0.647 . . . . 64.34 111.705 176.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -68.0 -57.24 6.49 Favored 'General case' 0 CA--C 1.556 1.187 0 C-N-CA 123.875 0.87 . . . . 65.31 112.73 -172.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 79.7 p -109.54 -37.65 5.65 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 123.44 0.696 . . . . 72.41 111.488 -178.648 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 135.36 164.23 10.33 Favored Glycine 0 N--CA 1.47 0.915 0 CA-C-N 116.111 -0.495 . . . . 30.43 112.38 -175.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.522 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.7 mp0 -59.05 -38.17 78.76 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.69 0.396 . . . . 51.55 110.976 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 81.0 p -60.02 -35.54 75.3 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.483 1.113 . . . . 54.41 112.57 177.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.93 -53.55 44.88 Favored Glycine 0 C--N 1.351 1.384 0 CA-C-O 121.345 0.414 . . . . 73.1 112.748 176.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.555 ' HB2' HD12 ' B' ' 106' ' ' ILE . 25.5 tp -67.93 -28.65 67.66 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 122.887 0.475 . . . . 74.52 111.696 175.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 56.8 m -59.72 -44.09 93.89 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 122.84 0.456 . . . . 73.05 109.974 173.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 26.5 mm-40 -70.96 -40.0 72.24 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.579 0.585 . . . . 72.04 112.579 177.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 91.2 mt -56.53 -47.79 78.62 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-O 121.504 0.669 . . . . 60.3 111.737 174.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.706 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 64.2 mt -73.93 -42.02 61.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.295 0.638 . . . . 74.35 111.756 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 7.9 tpt -54.74 -41.84 70.87 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.939 0.896 . . . . 74.41 111.989 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 12.1 t -71.53 -42.87 67.39 Favored 'General case' 0 N--CA 1.478 0.944 0 CA-C-O 119.119 -0.467 . . . . 70.51 111.43 172.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 61.2 mm-40 -62.35 -27.17 68.87 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.22 1.193 . . . . 73.43 114.22 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 15.0 m -73.69 -25.37 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 CA-C-N 118.75 0.705 . . . . 73.42 110.657 174.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.436 ' HE2' ' HB2' ' B' ' 124' ' ' MET . 44.3 mtm -82.3 -31.37 30.04 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 123.081 0.552 . . . . 65.32 110.388 176.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm -60.43 -53.91 51.95 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 124.309 1.043 . . . . 73.04 110.028 172.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 21.4 mt -64.44 -38.9 92.66 Favored 'General case' 0 C--O 1.21 -1.015 0 CA-C-N 114.196 -1.366 . . . . 53.42 112.122 174.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -60.68 -40.23 91.41 Favored 'General case' 0 N--CA 1.5 2.072 0 CA-C-N 118.388 0.54 . . . . 62.14 111.162 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.602 ' HA ' HE21 ' B' ' 131' ' ' GLN . 27.8 tptp -66.53 -46.54 75.83 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.306 1.042 . . . . 74.31 110.489 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.518 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.9 tptt -63.18 -42.77 99.41 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 115.431 -0.804 . . . . 42.42 111.052 179.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.429 HG23 ' O ' ' B' ' 126' ' ' LEU . 44.2 t -62.64 -51.41 72.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 C-N-CA 123.757 0.823 . . . . 72.34 111.428 178.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.602 HE21 ' HA ' ' B' ' 128' ' ' LYS . 27.5 pt20 -65.52 -30.62 71.4 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 117.486 0.13 . . . . 70.51 111.127 179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.509 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 17.6 t70 -62.83 -52.48 62.99 Favored 'General case' 0 C--N 1.354 0.786 0 N-CA-C 109.548 -0.538 . . . . 72.22 109.548 176.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 18.2 mt -66.11 -41.35 90.7 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.147 0.579 . . . . 71.32 112.241 -176.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.534 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.8 t -68.52 -32.48 72.47 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.547 0.339 . . . . 62.33 110.902 179.039 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.06 -42.46 89.46 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.236 0.615 . . . . 74.32 111.149 172.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.632 ' HB2' HD11 ' A' ' 137' ' ' LEU . 47.0 mt -79.63 -13.17 59.69 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 123.401 0.681 . . . . 71.32 111.499 178.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.722 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -84.54 -37.25 21.47 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-O 121.275 0.56 . . . . 72.41 109.554 172.412 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.1 t -74.69 -31.95 62.04 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.708 0.803 . . . . 74.12 111.556 175.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.6 t -146.95 96.48 2.75 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.324 1.05 . . . . 70.11 109.492 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.486 ' HD2' ' HD2' ' A' ' 140' ' ' LYS . 59.9 tttm -81.08 164.05 22.72 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.437 0.695 . . . . 71.24 112.524 -170.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -65.35 -7.15 12.22 Favored 'General case' 0 CA--C 1.562 1.421 0 C-N-CA 124.599 1.16 . . . . 51.42 113.761 177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 37.7 t70 . . . . . 0 CA--C 1.568 1.65 0 C-N-CA 123.785 0.834 . . . . 72.2 112.034 178.773 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.035 0 CA-C-O 120.332 -0.149 . . . . 74.14 112.943 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -78.35 176.78 9.01 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.246 0.618 . . . . 73.52 111.066 178.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.87 119.93 8.1 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.829 0.852 . . . . 72.41 113.028 -172.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -95.88 -49.72 5.19 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.242 1.017 . . . . 63.31 111.271 -177.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -70.98 124.98 25.61 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.034 0.534 . . . . 54.42 111.995 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -124.44 97.08 5.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.696 1.198 . . . . 72.04 111.006 -177.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.473 ' HB3' ' HB2' ' A' ' 73' ' ' HIS . 31.3 t70 -81.31 75.54 8.27 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 122.545 1.165 . . . . 73.33 111.056 177.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -80.36 -13.49 59.12 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-N 115.032 -0.986 . . . . 74.54 111.01 170.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -55.33 -35.37 65.11 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.764 1.226 . . . . 64.43 113.744 -173.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.4 p -66.11 -24.9 66.78 Favored 'General case' 0 N--CA 1.486 1.351 0 N-CA-C 113.689 0.996 . . . . 71.05 113.689 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.419 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 87.8 m95 -55.61 -24.37 32.75 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 113.276 0.843 . . . . 75.1 113.276 172.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.8 m -58.21 -29.74 65.92 Favored 'General case' 0 N--CA 1.494 1.758 0 N-CA-C 112.48 0.548 . . . . 63.21 112.48 175.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 47.1 t -74.16 -30.4 27.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.231 0 C-N-CA 123.734 0.813 . . . . 74.31 111.257 178.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 69.2 mt -80.77 -26.4 37.28 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 122.174 -0.329 . . . . 72.25 111.866 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 11.2 tp10 -48.34 -57.14 6.44 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 124.831 1.252 . . . . 72.43 113.168 -175.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -63.54 -8.68 27.52 Favored Glycine 0 CA--C 1.545 1.932 0 N-CA-C 115.02 0.768 . . . . 74.12 115.02 -179.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.1 -7.9 11.25 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.799 0.84 . . . . 71.22 112.095 178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 4.8 ppt_? -68.54 -23.81 64.56 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 118.69 0.677 . . . . 61.45 112.681 -171.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -59.62 -35.73 61.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 C-N-CA 122.912 0.485 . . . . 64.01 111.658 170.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 27.6 m -77.29 -41.85 39.21 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.315 0.646 . . . . 51.5 110.168 173.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.12 -29.77 70.57 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.059 0.544 . . . . 63.34 111.955 179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.595 HG22 ' HB ' ' A' ' 61' ' ' VAL . 46.6 p -78.44 -30.23 47.43 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.144 0.578 . . . . 74.21 112.119 174.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.8 t -85.09 -21.11 29.46 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 112.495 0.554 . . . . 71.13 112.495 -179.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.1 t -97.73 -54.31 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 N-CA-C 113.043 0.757 . . . . 73.13 113.043 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.402 HG13 ' CD1' ' A' ' 87' ' ' TYR . 2.6 mp -75.96 144.1 12.32 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.207 0.603 . . . . 73.41 111.633 -169.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -112.74 97.29 40.66 Favored Pre-proline 0 C--O 1.254 1.3 0 C-N-CA 123.55 0.74 . . . . 72.35 109.303 172.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.742 ' HA ' HG12 ' A' ' 30' ' ' ILE . 60.6 Cg_endo -68.65 -15.16 40.83 Favored 'Trans proline' 0 C--N 1.359 1.083 0 C-N-CA 122.483 2.122 . . . . 65.41 111.345 -173.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.4 m -67.84 -26.29 65.98 Favored 'General case' 0 C--N 1.35 0.595 0 C-N-CA 123.3 0.64 . . . . 62.52 110.658 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -93.56 -23.09 18.44 Favored 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 111.911 0.338 . . . . 75.22 111.911 175.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.742 HG12 ' HA ' ' A' ' 27' ' ' PRO . 2.1 pt -93.76 -2.74 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.837 0 O-C-N 122.167 -0.333 . . . . 72.12 111.794 -177.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.656 HG22 HD11 ' A' ' 40' ' ' LEU . 17.2 p -57.73 -48.16 97.68 Favored Pre-proline 0 CA--C 1.569 1.677 0 CA-C-O 117.955 -1.021 . . . . 51.3 113.447 176.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -67.02 -29.89 39.75 Favored 'Trans proline' 0 C--N 1.401 3.317 0 CA-C-N 121.778 1.671 . . . . 64.4 112.572 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.417 ' CD2' HD13 ' A' ' 118' ' ' LEU . 51.0 t80 -61.74 -54.43 42.58 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 123.45 0.7 . . . . 71.14 110.574 173.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.429 HD13 HD11 ' A' ' 64' ' ' LEU . 88.1 mt -65.93 -19.94 66.04 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 113.262 0.838 . . . . 74.13 113.262 179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.9 mmm180 -67.39 -46.97 71.67 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-O 120.735 0.302 . . . . 64.22 110.333 168.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -64.23 -22.86 67.1 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.202 0.601 . . . . 72.24 112.363 174.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -80.51 -12.8 59.49 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.758 0.823 . . . . 74.01 111.975 173.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt 62.8 40.97 9.34 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.635 1.174 . . . . 73.31 112.427 178.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.551 HG12 ' HG2' ' A' ' 74' ' ' LYS . 26.4 m -121.68 -44.92 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 C-N-CA 123.955 0.902 . . . . 63.51 111.995 -177.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.656 HD11 HG22 ' A' ' 31' ' ' THR . 10.5 tt -79.74 122.25 26.35 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.354 1.062 . . . . 75.12 111.791 -176.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -81.05 156.4 72.06 Favored Pre-proline 0 CA--C 1.558 1.282 0 C-N-CA 123.697 0.799 . . . . 72.34 111.78 179.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -57.24 -23.15 52.46 Favored 'Trans proline' 0 C--N 1.386 2.517 0 C-N-CA 123.102 2.534 . . . . 54.23 113.875 177.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -65.04 -43.73 91.39 Favored 'General case' 0 C--O 1.248 0.999 0 C-N-CA 123.933 0.893 . . . . 73.22 111.779 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -65.29 -59.3 4.21 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-N 116.468 -0.333 . . . . 74.43 110.512 -177.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.458 ' HB3' HD21 ' A' ' 40' ' ' LEU . 13.3 pt-20 -53.7 -36.59 62.38 Favored 'General case' 0 CA--C 1.553 1.064 0 N-CA-C 113.284 0.846 . . . . 71.35 113.284 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -72.53 -39.74 67.32 Favored 'General case' 0 CA--C 1.557 1.22 0 CA-C-N 118.64 0.654 . . . . 70.5 111.641 175.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -74.83 -22.38 58.74 Favored 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 118.468 0.576 . . . . 74.1 111.953 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -89.45 -40.78 13.38 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.37 0 C-N-CA 124.423 1.089 . . . . 74.12 111.754 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -75.61 -1.76 26.08 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 112.83 0.678 . . . . 71.54 112.83 177.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 90.4 p -60.62 -25.41 66.25 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-O 121.125 0.488 . . . . 53.0 110.487 165.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -114.11 107.32 52.11 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.331 1.052 . . . . 73.24 108.949 163.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -68.5 -36.9 14.1 Favored 'Trans proline' 0 CA--C 1.565 2.042 0 C-N-CA 122.066 1.844 . . . . 74.43 113.049 171.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -93.24 -161.37 0.84 Allowed 'General case' 0 N--CA 1.499 1.996 0 C-N-CA 123.71 0.804 . . . . 71.45 112.908 -173.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.595 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.6 pt? -88.66 13.57 11.98 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.477 1.111 . . . . 73.21 113.42 -178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 47.9 t -60.77 -57.15 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 112.463 0.542 . . . . 63.23 112.463 -167.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -116.81 27.42 3.45 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.445 0.698 . . . . 71.23 112.569 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.702 ' HA ' ' HG2' ' A' ' 60' ' ' LYS . 33.9 ptt180 -49.94 -25.16 3.01 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 113.589 0.959 . . . . 71.4 113.589 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.537 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -56.74 -45.07 82.19 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.606 0.762 . . . . 65.41 111.999 175.607 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -86.56 -37.75 17.84 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 112.868 0.692 . . . . 74.31 112.868 178.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.702 ' HG2' ' HA ' ' A' ' 57' ' ' ARG . 63.2 pttt -76.96 -26.54 54.11 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.226 0.824 . . . . 55.22 113.226 -171.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.735 HG22 ' HD3' ' A' ' 27' ' ' PRO . 21.9 t -71.99 -39.92 67.04 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.828 0 CA-C-N 118.9 0.773 . . . . 52.03 108.949 166.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.92 -42.83 96.95 Favored Glycine 0 C--N 1.35 1.36 0 CA-C-N 115.994 -0.548 . . . . 34.04 113.833 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.424 HG22 ' HA ' ' A' ' 60' ' ' LYS . 33.3 m -70.68 -38.4 72.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 CA-C-N 116.824 0.312 . . . . 73.12 110.806 177.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.429 HD11 HD13 ' A' ' 34' ' ' LEU . 51.2 tp -52.4 -52.75 52.07 Favored 'General case' 0 C--N 1.361 1.069 0 C-N-CA 123.507 0.723 . . . . 75.04 112.292 172.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 74.9 mt -55.3 -46.2 76.24 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.789 0.836 . . . . 74.53 111.599 -178.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -63.54 -37.95 89.28 Favored 'General case' 0 CA--C 1.565 1.542 0 CA-C-N 114.981 -1.008 . . . . 72.51 111.858 178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' ARG . 58.2 mt -74.37 -39.72 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.355 0.662 . . . . 74.32 111.713 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.8 mt -66.11 -29.91 70.32 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.865 -0.522 . . . . 74.43 110.489 175.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -64.24 -20.24 65.91 Favored 'General case' 0 CA--C 1.567 1.611 0 N-CA-C 113.226 0.824 . . . . 74.21 113.226 175.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 10.1 ptm180 -66.4 -20.69 66.13 Favored 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 118.489 0.586 . . . . 71.25 111.812 176.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.0 p -98.08 9.84 41.89 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.38 0.672 . . . . 34.32 110.916 176.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 64.5 -123.07 26.5 Favored Glycine 0 CA--C 1.536 1.354 0 N-CA-C 114.441 0.536 . . . . 74.52 114.441 -179.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.473 ' HB2' ' HB3' ' A' ' 7' ' ' ASP . 70.3 t60 -67.03 -27.91 67.8 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 124.467 1.107 . . . . 75.22 112.014 -179.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.551 ' HG2' HG12 ' A' ' 39' ' ' VAL . 80.6 tttt -60.1 -52.14 66.61 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.663 0.785 . . . . 73.31 112.448 -177.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.61 -35.14 89.47 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 116.06 -0.518 . . . . 61.24 113.287 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.7 t80 -52.44 -57.25 10.44 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.91 0.884 . . . . 63.03 111.587 170.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.472 HG23 ' O ' ' A' ' 73' ' ' HIS . 87.0 t -52.7 -48.64 48.56 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.84 0.856 . . . . 52.11 111.033 175.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.41 -40.46 91.06 Favored 'General case' 0 CA--C 1.55 0.958 0 O-C-N 124.117 0.885 . . . . 75.13 113.177 -177.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -70.12 -43.38 71.12 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-N 118.53 0.605 . . . . 72.43 111.137 175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 99.1 mt -59.72 -36.14 75.96 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-O 121.166 0.508 . . . . 61.01 112.223 176.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.444 ' HG3' ' HA ' ' A' ' 103' ' ' PHE . 31.1 tt0 -70.58 -45.97 64.35 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.544 1.538 . . . . 72.11 111.646 177.695 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . 0.404 ' O ' ' HD1' ' A' ' 86' ' ' TYR . 69.4 m -61.19 -36.43 79.85 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.445 0.64 . . . . 71.42 109.515 172.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 14.9 tp -71.97 -38.13 69.8 Favored 'General case' 0 C--O 1.208 -1.116 0 CA-C-N 115.768 -0.651 . . . . 75.23 109.98 178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -61.83 -25.74 67.69 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.707 0.803 . . . . 74.2 111.377 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 7.2 tt -91.19 -60.19 1.96 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 123.624 0.77 . . . . 73.32 110.893 176.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.404 ' HD1' ' O ' ' A' ' 82' ' ' SER . 86.2 m-85 -75.91 -42.69 48.21 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.247 1.019 . . . . 74.13 113.093 -169.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.538 ' HB3' HD23 ' A' ' 90' ' ' LEU . 98.3 m-85 -138.85 70.05 43.25 Favored Pre-proline 0 N--CA 1.496 1.843 0 CA-C-N 118.362 0.528 . . . . 71.13 110.579 176.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 30.7 Cg_endo -60.23 -28.68 87.38 Favored 'Trans proline' 0 C--N 1.379 2.163 0 C-N-CA 122.81 2.34 . . . . 73.31 113.545 -171.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -68.95 -35.41 76.75 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.072 0.949 . . . . 71.11 112.275 175.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.538 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.4 mm? -62.55 -35.68 80.23 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.153 0.581 . . . . 71.42 110.046 173.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 72.1 t80 -68.81 -47.68 65.49 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 115.884 -0.598 . . . . 73.1 111.087 173.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 40.9 mmtm -64.07 -24.75 67.82 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.493 0.923 . . . . 71.32 113.493 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.49 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.6 ptmm? -86.4 -31.46 21.44 Favored 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 118.415 0.552 . . . . 75.32 112.254 177.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 20.3 m -74.66 -33.04 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 CA-C-N 118.634 0.652 . . . . 74.02 111.787 174.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 78.5 p -91.68 -45.49 8.42 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.222 0.609 . . . . 62.14 112.117 179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 99.28 -17.33 58.05 Favored Glycine 0 CA--C 1.536 1.36 0 CA-C-N 116.129 -0.487 . . . . 42.33 113.596 -177.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -135.04 163.37 30.03 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 117.304 0.552 . . . . 71.11 111.992 -174.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -90.83 96.55 0.99 Allowed Pre-proline 0 CA--C 1.558 1.279 0 C-N-CA 124.0 0.92 . . . . 74.21 109.013 170.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -96.54 -97.34 0.0 OUTLIER 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 122.97 2.446 . . . . 62.32 114.774 -166.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -106.33 -28.27 10.48 Favored 'General case' 0 N--CA 1.482 1.147 0 N-CA-C 114.442 1.275 . . . . 62.45 114.442 -168.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 61.81 59.92 1.67 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.091 0.556 . . . . 71.13 110.61 -171.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.4 t -73.28 49.74 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.883 0 N-CA-C 114.497 1.295 . . . . 74.43 114.497 -167.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.444 ' HA ' ' HG3' ' A' ' 81' ' ' GLU . 97.6 m-85 -62.02 -5.26 2.06 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.715 0.806 . . . . 74.41 112.797 166.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 25.9 t -59.06 -22.27 60.46 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 124.371 1.068 . . . . 62.55 113.171 178.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 36.7 tpp -64.39 -59.75 3.98 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.798 0.439 . . . . 63.44 110.877 175.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.476 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -66.22 -36.4 77.32 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.258 0 C-N-CA 124.165 0.986 . . . . 63.32 111.026 179.047 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 103' ' ' PHE . 41.2 mm -59.64 -54.42 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 122.578 0.351 . . . . 74.15 110.936 175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -63.01 -39.05 93.59 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 112.411 0.523 . . . . 70.11 112.411 177.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.09 -58.29 5.18 Favored 'General case' 0 N--CA 1.481 1.083 0 N-CA-C 113.257 0.836 . . . . 75.42 113.257 -175.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.5 p -108.55 -39.11 5.5 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.191 0.596 . . . . 33.21 111.919 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 138.77 160.71 8.49 Favored Glycine 0 N--CA 1.479 1.541 0 N-CA-C 113.417 0.127 . . . . 70.43 113.417 -177.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -59.72 -48.32 82.16 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.407 0.683 . . . . 75.44 111.405 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.3 p -62.71 -28.32 69.87 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.349 0.66 . . . . 73.22 111.908 175.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.19 -56.13 26.95 Favored Glycine 0 C--N 1.352 1.448 0 N-CA-C 112.312 -0.315 . . . . 62.22 112.312 172.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.476 ' HB2' HD12 ' A' ' 106' ' ' ILE . 40.1 tp -62.35 -32.41 73.19 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 122.615 0.366 . . . . 73.44 111.731 173.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 93.3 m -63.1 -39.49 94.85 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.042 0.537 . . . . 73.24 111.193 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 -70.63 -43.0 70.15 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 122.811 0.444 . . . . 74.11 111.276 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 87.8 mt -55.19 -53.63 53.6 Favored 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 116.246 -0.434 . . . . 61.11 111.004 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 85.4 mt -60.5 -40.17 90.4 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.801 0.84 . . . . 61.44 111.966 176.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.7 tpt -60.83 -33.6 73.29 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.221 0.608 . . . . 72.11 111.831 178.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.8 t -84.38 -33.55 23.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.418 0.525 . . . . 70.43 112.418 173.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 50.6 mm-40 -65.72 -32.74 74.47 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 122.864 0.466 . . . . 72.15 112.254 -179.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 119' ' ' LEU . 20.0 m -66.63 -27.31 39.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.081 0 CA-C-O 119.847 -0.121 . . . . 74.53 111.032 173.061 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 66.8 mtm -81.94 -40.64 21.97 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.763 0.425 . . . . 64.33 110.24 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -55.53 -47.0 77.0 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.095 0.958 . . . . 73.22 110.894 172.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 15.9 mt -72.85 -32.16 65.25 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.194 -0.912 . . . . 73.25 111.46 177.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -65.93 -28.61 69.05 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 122.643 0.377 . . . . 73.23 111.287 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -73.87 -46.68 43.27 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.288 0.635 . . . . 44.41 110.259 174.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.446 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.7 tptt -57.95 -46.76 84.59 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.761 0.825 . . . . 73.31 111.146 177.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 41.7 t -64.38 -48.96 83.06 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.617 0.767 . . . . 62.11 111.081 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.615 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.2 pt20 -66.23 -28.73 68.95 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-N 117.929 0.331 . . . . 73.41 111.617 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.488 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.7 t70 -68.27 -43.65 77.31 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 123.082 0.553 . . . . 54.32 110.159 176.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.1 mt -73.37 -36.5 66.09 Favored 'General case' 0 CA--C 1.548 0.866 0 CA-C-N 116.266 -0.425 . . . . 75.35 110.714 -177.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.615 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.8 t -75.55 -22.92 56.61 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.319 0.247 . . . . 74.54 111.367 177.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.73 -41.23 88.21 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.168 0.509 . . . . 42.54 110.063 169.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.614 ' HB2' HD11 ' B' ' 137' ' ' LEU . 52.8 mt -83.57 -16.78 44.06 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.688 0.795 . . . . 63.34 112.1 179.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.556 HD23 ' HE2' ' B' ' 140' ' ' LYS . 0.8 OUTLIER -82.73 -46.71 12.83 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.559 0.744 . . . . 45.45 109.534 175.026 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.1 t -67.88 -24.82 65.28 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 61.13 112.06 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 39.3 t -154.87 110.45 3.12 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.254 0.622 . . . . 74.34 111.013 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -103.13 154.25 19.49 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.196 0.598 . . . . 71.41 110.384 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.09 -32.71 74.33 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.281 0.632 . . . . 62.43 112.292 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.568 1.668 0 C-N-CA 123.861 0.864 . . . . 73.44 110.996 -178.221 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 CA-C-O 120.672 0.04 . . . . 64.41 113.185 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 47.9 t -83.77 -42.6 16.34 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.244 0.618 . . . . 74.14 112.096 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.01 116.05 9.93 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.164 0.586 . . . . 72.11 111.288 -176.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -81.11 -24.16 37.88 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.25 0.62 . . . . 75.11 110.531 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -70.38 89.04 0.67 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.42 0.688 . . . . 72.3 111.193 176.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -87.05 93.24 9.31 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.886 0.851 . . . . 64.42 109.216 170.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -88.2 38.59 0.86 Allowed 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 122.19 0.995 . . . . 63.54 111.226 -173.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -75.15 -13.97 60.51 Favored 'General case' 0 CA--C 1.553 1.064 0 C-N-CA 123.76 0.824 . . . . 72.04 112.241 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -61.46 -38.22 86.45 Favored 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 123.454 0.702 . . . . 73.53 112.657 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 21.4 p -62.85 -26.62 68.85 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 80.3 m95 -52.46 -20.36 2.82 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 113.773 1.027 . . . . 73.23 113.773 168.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 47.2 t -62.02 -25.89 67.92 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.442 0.697 . . . . 63.52 112.212 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 83.2 t -62.43 -55.64 22.62 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.336 0.655 . . . . 75.23 110.28 173.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.38 -35.1 79.78 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.116 0.567 . . . . 75.22 111.305 176.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.45 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -63.59 -38.39 90.96 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.632 0.773 . . . . 75.44 111.269 -179.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -16.99 42.19 Favored Glycine 0 CA--C 1.54 1.644 0 N-CA-C 114.43 0.532 . . . . 65.25 114.43 172.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -118.33 3.57 11.91 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.958 0.903 . . . . 74.53 111.566 177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.45 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 37.6 ptt180 -64.82 -27.63 69.01 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.977 0.732 . . . . 61.41 112.977 -168.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 13.1 p -58.73 -32.9 47.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 CA-C-O 121.017 0.437 . . . . 75.42 111.015 177.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 8.6 m -91.11 -42.83 10.26 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.606 0.763 . . . . 50.45 111.104 177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.625 HD23 HD12 ' B' ' 90' ' ' LEU . 91.3 mt -54.34 -47.5 72.47 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.161 0.585 . . . . 75.42 111.598 178.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.441 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 82.8 p -67.52 -28.23 67.64 Favored 'General case' 0 N--CA 1.478 0.941 0 CA-C-N 115.976 -0.556 . . . . 74.33 112.037 -178.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.1 t -76.45 -41.86 45.95 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.353 0.661 . . . . 62.53 112.04 178.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.771 HG11 HD21 ' B' ' 90' ' ' LEU . 47.0 t -83.24 -46.9 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 112.575 0.583 . . . . 51.11 112.575 -175.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.1 mt -80.06 153.08 4.53 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 124.207 1.003 . . . . 71.23 111.197 -175.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 7.3 t70 -132.32 128.68 21.3 Favored Pre-proline 0 C--O 1.252 1.2 0 O-C-N 122.246 -0.284 . . . . 71.51 111.217 172.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.562 ' HG2' ' HB3' ' B' ' 60' ' ' LYS . 53.0 Cg_exo -57.74 -17.52 29.7 Favored 'Trans proline' 0 C--N 1.38 2.198 0 C-N-CA 123.133 2.555 . . . . 75.24 113.944 -179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 95.8 p -64.3 -32.5 74.13 Favored 'General case' 0 N--CA 1.48 1.038 0 O-C-N 121.946 -0.471 . . . . 60.45 111.137 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 15.1 ptm180 -94.04 -30.22 14.81 Favored 'General case' 0 N--CA 1.484 1.237 0 N-CA-C 111.824 0.305 . . . . 72.33 111.824 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.475 HG12 ' HA ' ' B' ' 27' ' ' PRO . 39.2 pt -94.39 -30.5 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 113.294 0.85 . . . . 71.22 113.294 -173.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.478 ' HA ' HD12 ' B' ' 34' ' ' LEU . 82.0 p -62.76 -36.91 29.44 Favored Pre-proline 0 N--CA 1.507 2.419 0 N-CA-C 114.258 1.207 . . . . 74.42 114.258 -176.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -62.37 -34.11 77.9 Favored 'Trans proline' 0 C--N 1.396 3.066 0 CA-C-N 121.887 1.71 . . . . 72.33 113.163 172.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -67.03 -45.37 77.68 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.49 0.716 . . . . 74.21 110.407 173.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' B' ' 31' ' ' THR . 68.9 mt -64.19 -26.38 68.49 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.671 1.188 . . . . 71.5 112.659 177.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.4 mmm180 -61.65 -48.42 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.27 0.628 . . . . 61.54 110.444 169.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.43 ' HG3' HD21 ' B' ' 118' ' ' LEU . 12.2 mm100 -65.43 -31.72 72.97 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-N 115.381 -0.827 . . . . 70.3 111.377 176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 37.8 m -72.17 -14.41 61.8 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.586 0.754 . . . . 60.21 111.63 172.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.617 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.1 mmtt 71.07 2.24 4.15 Favored 'General case' 0 N--CA 1.495 1.79 0 C-N-CA 125.285 1.434 . . . . 61.23 112.952 176.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.9 m -86.24 5.33 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 123.46 0.704 . . . . 74.21 112.351 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.438 HD12 HD21 ' B' ' 68' ' ' LEU . 9.8 tt -142.37 128.52 19.76 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.145 0.978 . . . . 71.24 109.543 -173.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -91.45 155.82 43.82 Favored Pre-proline 0 CA--C 1.555 1.15 0 C-N-CA 124.399 1.08 . . . . 70.21 110.564 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -62.48 -16.12 49.95 Favored 'Trans proline' 0 C--N 1.381 2.283 0 C-N-CA 122.533 2.155 . . . . 51.55 113.969 -176.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.78 -31.89 31.65 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.324 0.649 . . . . 75.15 112.022 175.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' B' ' 47' ' ' GLN . 75.1 m-20 -63.88 -60.27 3.49 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.244 0.618 . . . . 54.02 111.912 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -45.13 -44.21 10.41 Favored 'General case' 0 CA--C 1.564 1.499 0 N-CA-C 113.634 0.975 . . . . 70.22 113.634 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -78.01 -36.5 48.7 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.899 -0.501 . . . . 73.52 112.217 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.404 ' HG2' ' O ' ' B' ' 44' ' ' ASP . 12.7 pt20 -71.16 -29.43 65.19 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 118.46 0.573 . . . . 75.33 111.342 178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 88.0 t -73.24 -48.66 41.98 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.104 0 C-N-CA 123.091 0.557 . . . . 70.14 111.094 172.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.99 67.81 9.23 Favored 'General case' 0 N--CA 1.485 1.292 0 CA-C-O 122.001 0.905 . . . . 70.42 111.556 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -96.85 -22.04 17.14 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.237 1.015 . . . . 73.21 109.525 168.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.421 ' HB2' HD11 ' B' ' 56' ' ' ILE . 23.7 t70 -53.4 140.47 45.55 Favored Pre-proline 0 N--CA 1.481 1.118 0 C-N-CA 126.101 1.76 . . . . 71.51 111.852 168.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' B' ' 51' ' ' ASP . 2.8 Cg_endo -39.82 -70.0 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.435 0 C-N-CA 123.668 2.912 . . . . 74.43 113.309 169.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -135.0 -87.18 0.38 Allowed 'General case' 0 N--CA 1.493 1.708 0 CA-C-N 118.735 0.698 . . . . 61.14 112.839 175.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 1.1 pp -126.77 38.03 4.18 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 113.298 0.851 . . . . 71.35 113.298 179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 13.3 t -86.57 -57.7 4.06 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.659 0 C-N-CA 123.711 0.805 . . . . 75.11 112.682 -169.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.542 HD12 ' HG3' ' B' ' 60' ' ' LYS . 2.8 pp -98.3 31.48 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.537 0 N-CA-C 113.61 0.967 . . . . 64.42 113.61 -179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.462 ' HA ' ' HB2' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -45.09 -25.82 0.38 Allowed 'General case' 0 N--CA 1.508 2.425 0 N-CA-C 115.086 1.513 . . . . 63.2 115.086 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -56.51 -46.47 80.53 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 123.815 0.846 . . . . 72.25 111.408 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -84.44 -29.76 25.85 Favored 'General case' 0 CA--C 1.564 1.506 0 N-CA-C 112.08 0.4 . . . . 50.24 112.08 176.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.562 ' HB3' ' HG2' ' B' ' 27' ' ' PRO . 51.6 mtmt -61.32 -55.52 30.79 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 113.024 0.75 . . . . 73.44 113.024 -179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.492 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 25.8 t -66.38 -29.62 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.225 0 N-CA-C 109.874 -0.417 . . . . 64.31 109.874 178.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.99 -53.34 46.57 Favored Glycine 0 C--N 1.357 1.716 0 CA-C-N 116.293 -0.412 . . . . 73.31 113.074 179.057 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 34.5 m -69.17 -30.3 45.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 CA-C-N 116.737 0.269 . . . . 74.11 111.579 175.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 27' ' ' PRO . 38.3 tp -65.68 -31.63 72.74 Favored 'General case' 0 CA--C 1.558 1.265 0 C-N-CA 123.429 0.692 . . . . 71.32 112.609 178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -58.76 -51.87 68.13 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.569 0.347 . . . . 54.2 110.452 175.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -59.9 -34.46 73.21 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.236 1.015 . . . . 72.41 112.079 175.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 49.5 mt -64.53 -60.08 3.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.033 0 C-N-CA 123.14 0.576 . . . . 64.02 111.628 176.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.446 HD21 HD13 ' B' ' 34' ' ' LEU . 67.2 mt -59.84 -27.57 66.75 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.218 0.607 . . . . 60.31 111.973 178.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -61.9 -20.19 63.49 Favored 'General case' 0 CA--C 1.57 1.747 0 C-N-CA 124.379 1.072 . . . . 73.42 113.379 174.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -58.74 -22.22 57.18 Favored 'General case' 0 N--CA 1.504 2.257 0 C-N-CA 123.155 0.582 . . . . 74.51 112.165 173.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.2 p -104.14 15.73 27.78 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.529 0.732 . . . . 74.33 111.589 -179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.61 -124.92 32.28 Favored Glycine 0 C--N 1.353 1.51 0 N-CA-C 115.401 0.92 . . . . 31.24 115.401 179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -74.22 -22.94 59.14 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.123 0.969 . . . . 73.1 111.464 -178.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 43.3 mtmt -61.94 -51.75 66.85 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 111.903 0.334 . . . . 60.23 111.903 -179.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.21 -33.08 82.98 Favored Glycine 0 C--N 1.345 1.056 0 CA-C-N 116.003 -0.544 . . . . 75.03 112.992 175.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 52.3 t80 -60.07 -54.71 42.72 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.737 0.815 . . . . 73.04 111.902 173.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 81.6 t -59.46 -42.55 88.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.49 0 C-N-CA 123.123 0.569 . . . . 54.22 110.765 176.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -65.31 -35.89 82.38 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 123.532 0.733 . . . . 73.2 112.481 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 55.1 t80 -70.24 -43.78 69.88 Favored 'General case' 0 N--CA 1.482 1.146 0 N-CA-C 110.296 -0.261 . . . . 74.22 110.296 175.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.434 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 95.4 mt -60.66 -39.39 88.17 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.525 0.73 . . . . 64.53 111.468 176.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.92 -48.3 69.08 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.923 1.689 . . . . 75.12 111.467 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 68.5 m -59.33 -40.47 86.4 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-N 115.882 -0.599 . . . . 61.32 110.501 173.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.429 HD12 ' HB2' ' B' ' 87' ' ' TYR . 18.8 tp -70.49 -38.35 74.33 Favored 'General case' 0 C--O 1.212 -0.887 0 C-N-CA 123.17 0.588 . . . . 62.3 111.236 -177.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.402 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 43.5 tt0 -63.19 -28.22 69.9 Favored 'General case' 0 CA--C 1.557 1.245 0 C-N-CA 124.415 1.086 . . . . 71.33 111.201 -179.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.9 tt -87.51 -62.57 1.47 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 124.446 1.099 . . . . 71.22 110.463 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -73.45 -43.11 61.03 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 113.936 1.087 . . . . 73.25 113.936 -172.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' B' ' 90' ' ' LEU . 88.2 m-85 -130.24 79.19 73.16 Favored Pre-proline 0 N--CA 1.494 1.742 0 CA-C-N 118.239 0.472 . . . . 64.1 111.794 -177.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . 0.466 ' O ' ' HG2' ' B' ' 92' ' ' LYS . 27.8 Cg_endo -59.83 -38.83 77.34 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.672 2.248 . . . . 74.21 112.921 -176.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.558 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.6 pt20 -63.93 -40.82 97.36 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.142 0.977 . . . . 71.13 112.644 178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.771 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -65.21 -35.0 79.7 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.09 0.556 . . . . 52.22 110.647 176.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 44.8 t80 -68.76 -46.45 68.77 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.1 -0.5 . . . . 74.4 110.683 176.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.511 ' HE3' ' HD3' ' B' ' 99' ' ' PRO . 46.8 mmtm -59.26 -38.36 79.88 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.542 0.737 . . . . 72.55 112.616 177.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -76.61 -36.17 57.64 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.842 0.682 . . . . 65.4 112.842 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 22.4 m -71.76 -38.34 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 CA-C-N 118.692 0.678 . . . . 54.4 112.337 175.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 70.7 p -86.63 -40.29 15.28 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.945 0.498 . . . . 55.34 111.994 -177.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.13 2.98 90.51 Favored Glycine 0 N--CA 1.475 1.236 0 CA-C-N 116.24 -0.436 . . . . 15.41 113.877 -177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.32 179.45 6.64 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.472 0.709 . . . . 73.23 112.061 -176.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -72.89 144.41 85.4 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.537 0.735 . . . . 72.23 111.387 176.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.511 ' HD3' ' HE3' ' B' ' 92' ' ' LYS . 71.9 Cg_endo -71.27 138.8 33.87 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.695 2.264 . . . . 64.31 113.159 -172.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -79.53 -27.33 41.35 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.672 0.789 . . . . 42.12 111.508 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.425 ' HD2' ' HB2' ' B' ' 99' ' ' PRO . 10.7 mmm-85 73.96 47.56 0.15 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 125.595 1.558 . . . . 72.11 110.858 175.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.8 t -81.28 52.6 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 124.552 1.141 . . . . 70.14 112.197 -178.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -60.99 3.5 0.09 Allowed 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 114.013 1.116 . . . . 71.32 114.013 173.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 66.8 m -58.4 -20.04 40.96 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.353 1.061 . . . . 75.01 113.004 178.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 33.6 tpp -63.95 -63.65 1.1 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 122.703 0.401 . . . . 74.23 110.894 174.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.444 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.26 -30.2 46.97 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 C-N-CA 123.587 0.755 . . . . 62.44 111.173 -179.404 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 43.2 mm -66.12 -48.17 82.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 122.888 0.475 . . . . 65.34 111.412 175.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -70.32 -30.28 67.22 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.915 -0.491 . . . . 64.34 112.031 175.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.617 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.43 -62.39 1.71 Allowed 'General case' 0 CA--C 1.556 1.211 0 N-CA-C 113.226 0.824 . . . . 65.31 113.226 -176.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 35.2 t -105.87 6.14 31.28 Favored 'General case' 0 N--CA 1.499 2.007 0 C-N-CA 123.779 0.832 . . . . 72.41 112.271 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 81.89 164.39 33.66 Favored Glycine 0 CA--C 1.534 1.247 0 CA-C-O 120.918 0.177 . . . . 30.43 113.207 -176.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -60.7 -38.26 84.45 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.11 0.564 . . . . 51.55 110.222 170.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.412 ' O ' ' HG2' ' B' ' 117' ' ' GLN . 88.9 p -52.31 -43.35 64.47 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.557 1.143 . . . . 54.41 111.82 173.092 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.63 -54.05 40.92 Favored Glycine 0 C--N 1.355 1.634 0 O-C-N 123.45 0.468 . . . . 73.1 113.747 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.444 ' HB2' HD12 ' B' ' 106' ' ' ILE . 28.7 tp -66.52 -32.77 74.33 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 122.489 0.316 . . . . 74.52 111.446 179.188 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 27.3 m -58.57 -47.95 82.55 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.197 0.599 . . . . 73.05 110.538 172.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' B' ' 113' ' ' SER . 28.6 mm-40 -64.14 -41.87 97.01 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 112.638 0.607 . . . . 72.04 112.638 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.43 HD21 ' HG3' ' B' ' 36' ' ' GLN . 96.8 mt -59.54 -53.85 53.34 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 123.295 0.638 . . . . 60.3 111.342 178.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.615 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 85.1 mt -65.04 -41.25 95.4 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.106 -0.952 . . . . 74.35 112.161 179.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.518 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -64.88 -48.19 75.14 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.006 0.522 . . . . 74.41 111.322 -178.917 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 15.1 t -62.94 -37.61 87.72 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 120.489 -0.484 . . . . 70.51 111.255 174.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -59.22 -33.9 71.54 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.888 0.475 . . . . 73.43 111.976 176.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.518 HG22 ' O ' ' B' ' 120' ' ' MET . 1.8 m -64.19 -33.31 61.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 CA-C-N 118.621 0.646 . . . . 73.42 110.358 175.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 47.8 mtm -79.52 -34.05 41.5 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 122.931 0.493 . . . . 65.32 110.736 -176.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -56.77 -50.28 72.76 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.379 1.072 . . . . 73.04 110.184 170.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.614 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 18.1 mt -60.59 -42.23 96.31 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 114.25 -1.341 . . . . 53.42 113.196 174.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . 0.446 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 98.7 mt-30 -62.66 -39.65 94.58 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.244 0.617 . . . . 62.14 111.776 177.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -67.96 -36.26 79.78 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-N 115.914 -0.584 . . . . 74.31 110.785 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.561 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 47.8 tptt -68.82 -33.06 73.22 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 122.876 0.471 . . . . 42.42 111.111 176.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.525 HG23 ' O ' ' B' ' 126' ' ' LEU . 62.3 t -64.27 -50.25 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.234 0.614 . . . . 72.34 110.089 176.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.627 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.6 pt20 -68.35 -29.96 68.81 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 116.1 -0.5 . . . . 70.51 111.005 -179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -61.77 -37.37 84.05 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.059 0.944 . . . . 72.22 111.257 174.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 21.8 mt -84.63 -41.87 15.94 Favored 'General case' 0 N--CA 1.475 0.775 0 CA-C-N 116.033 -0.53 . . . . 71.32 111.409 -175.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.627 HG22 ' HA ' ' B' ' 131' ' ' GLN . 11.9 t -65.95 -31.67 72.73 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.204 0.202 . . . . 62.33 111.265 175.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.58 -44.77 77.23 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.67 0.788 . . . . 74.32 112.103 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . . . . . . . . . 24.4 mt -81.23 -46.06 15.36 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.831 -0.622 . . . . 71.32 110.327 -178.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -51.86 -42.73 62.86 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 125.342 1.457 . . . . 72.41 112.507 177.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 40.6 t -58.62 -38.56 78.3 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 124.023 0.929 . . . . 74.12 113.349 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.4 t -140.65 101.68 4.14 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.274 0.63 . . . . 70.11 109.627 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.556 ' HE2' HD23 ' A' ' 137' ' ' LEU . 7.7 mtpm? -105.04 -167.12 1.3 Allowed 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.591 0.756 . . . . 71.24 111.46 -174.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -123.87 21.25 9.13 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.249 0.619 . . . . 51.42 112.217 -178.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 . . . . . 0 N--CA 1.492 1.641 0 C-N-CA 123.362 0.665 . . . . 72.2 112.125 -176.437 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.901 0 CA-C-O 120.476 -0.069 . . . . 74.14 112.974 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.2 t -154.79 31.32 0.41 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.669 0.747 . . . . 73.52 110.663 179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -152.71 -78.44 0.11 Allowed 'General case' 0 CA--C 1.562 1.441 0 CA-C-N 115.461 -0.79 . . . . 72.41 112.311 -170.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -110.0 -61.56 1.64 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.648 -0.657 . . . . 63.31 112.491 -172.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -88.29 171.14 10.4 Favored 'General case' 0 N--CA 1.49 1.536 0 N-CA-C 112.486 0.55 . . . . 54.42 112.486 -175.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.5 m-80 -95.21 153.08 17.83 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 123.716 0.806 . . . . 72.04 111.181 -177.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -121.23 111.53 17.51 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 123.548 0.739 . . . . 73.33 111.287 -179.505 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -81.28 -38.87 26.14 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.064 0.945 . . . . 74.54 112.6 -175.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.7 tm-20 -59.72 -21.53 60.78 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 123.823 0.849 . . . . 64.43 111.303 -177.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 t -47.28 -47.38 25.13 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.662 1.185 . . . . 71.05 111.892 170.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 64.6 m95 -62.81 -18.64 63.09 Favored 'General case' 0 N--CA 1.478 0.935 0 N-CA-C 115.162 1.541 . . . . 75.1 115.162 179.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.9 t -54.75 -26.21 32.69 Favored 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 112.994 0.739 . . . . 63.21 112.994 -177.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.8 t -63.94 -53.6 42.05 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 C-N-CA 123.371 0.669 . . . . 74.31 111.022 172.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 90.8 mt -71.03 -33.98 70.85 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 122.821 0.448 . . . . 72.25 111.884 178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -54.68 -49.12 71.42 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.02 1.328 . . . . 72.43 112.314 -174.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -60.6 -18.3 51.33 Favored Glycine 0 CA--C 1.54 1.608 0 N-CA-C 114.603 0.601 . . . . 74.12 114.603 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -110.0 -3.49 16.47 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.135 0.574 . . . . 71.22 111.495 178.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' HB2' ' A' ' 21' ' ' LEU . 15.5 ptt180 -65.18 -24.32 67.35 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 111.759 0.281 . . . . 61.45 111.759 -173.084 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.4 p -52.34 -37.64 23.67 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.261 0.624 . . . . 64.01 111.927 171.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.9 m -86.82 -41.64 13.9 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.805 0.842 . . . . 51.5 111.141 174.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.55 HD22 HD11 ' A' ' 25' ' ' ILE . 81.7 mt -59.92 -35.58 75.2 Favored 'General case' 0 N--CA 1.495 1.793 0 C-N-CA 123.058 0.543 . . . . 63.34 112.314 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.472 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 44.2 p -74.94 -24.37 58.47 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.346 0.658 . . . . 74.21 112.367 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 69.5 m -77.3 -48.82 16.43 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 122.719 0.408 . . . . 71.13 111.181 172.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.553 HG11 HD21 ' A' ' 90' ' ' LEU . 58.1 t -83.36 -50.59 15.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.804 1.039 . . . . 73.13 113.804 -167.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.55 HD11 HD22 ' A' ' 21' ' ' LEU . 50.6 mt -76.47 141.17 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.103 0.561 . . . . 73.41 111.353 -173.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.466 ' HB2' ' HG2' ' A' ' 29' ' ' ARG . 4.1 m-20 -103.55 110.14 63.27 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.014 0.526 . . . . 72.35 110.176 178.122 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.743 ' HD3' HG22 ' A' ' 61' ' ' VAL . 91.3 Cg_endo -72.69 -5.11 16.57 Favored 'Trans proline' 0 C--N 1.368 1.592 0 C-N-CA 123.02 2.48 . . . . 65.41 111.592 -177.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 m -86.2 -27.28 24.61 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.845 1.258 . . . . 62.52 111.141 175.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.466 ' HG2' ' HB2' ' A' ' 26' ' ' ASP . 16.0 ptp180 -90.67 -28.49 18.33 Favored 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 118.189 0.45 . . . . 75.22 111.818 -177.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 32.0 pt -92.39 2.42 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.077 0.551 . . . . 72.12 111.539 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 25.6 m -55.35 -57.04 22.48 Favored Pre-proline 0 CA--C 1.567 1.61 0 C-N-CA 123.681 0.793 . . . . 51.3 112.554 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -64.36 -28.02 63.21 Favored 'Trans proline' 0 C--N 1.402 3.385 0 C-N-CA 121.688 1.592 . . . . 64.4 113.233 -179.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 8.7 t80 -67.08 -48.35 68.47 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.687 0.395 . . . . 71.14 110.591 175.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.471 HD13 HD11 ' A' ' 64' ' ' LEU . 87.7 mt -65.35 -23.34 66.97 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.491 0.716 . . . . 74.13 112.442 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -68.86 -48.18 64.09 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.054 0.541 . . . . 64.22 110.7 168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.569 ' HG3' HD11 ' A' ' 118' ' ' LEU . 14.9 mm100 -59.63 -31.59 69.65 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.761 0.824 . . . . 72.24 111.692 173.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -80.74 -7.81 59.48 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.719 0.808 . . . . 74.01 112.17 175.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 67.47 31.24 6.41 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 124.891 1.277 . . . . 73.31 112.098 169.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.4 m -119.89 -33.97 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 123.412 0.685 . . . . 63.51 112.578 -175.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.5 tt -79.79 118.24 21.4 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.057 0.543 . . . . 75.12 109.845 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.4 152.47 70.37 Favored Pre-proline 0 CA--C 1.553 1.065 0 C-N-CA 123.642 0.777 . . . . 72.34 111.682 178.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.446 ' O ' ' HG2' ' A' ' 46' ' ' GLU . 19.1 Cg_endo -55.62 -18.21 19.78 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 123.387 2.725 . . . . 54.23 114.726 178.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -71.66 -43.08 66.67 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.524 0.73 . . . . 73.22 111.812 175.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.459 ' HA ' ' HG2' ' A' ' 47' ' ' GLN . 24.4 t70 -62.99 -57.68 9.9 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.923 -0.58 . . . . 74.43 111.627 -174.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -47.64 -34.06 7.55 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.038 0.755 . . . . 71.35 113.038 175.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 42' ' ' PRO . 26.0 mm-40 -72.3 -52.78 14.71 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.833 0.309 . . . . 70.5 111.833 175.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.459 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 11.1 pt20 -65.28 -33.44 75.99 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 112.623 0.601 . . . . 74.1 112.623 -176.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.37 -22.87 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 124.384 1.074 . . . . 74.12 111.434 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.57 9.55 29.4 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.123 0.569 . . . . 71.54 112.184 176.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.4 t -90.03 -8.26 51.97 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 123.424 0.69 . . . . 53.0 112.798 -175.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.402 ' HB2' HD11 ' A' ' 56' ' ' ILE . 5.2 p-10 -78.62 145.67 67.67 Favored Pre-proline 0 CA--C 1.559 1.304 0 C-N-CA 123.761 0.824 . . . . 73.24 112.406 -177.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -85.21 -2.09 9.37 Favored 'Trans proline' 0 CA--C 1.565 2.033 0 C-N-CA 123.14 2.56 . . . . 74.43 114.683 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.512 ' HB3' HG23 ' A' ' 55' ' ' VAL . 38.2 m-80 -151.67 141.86 22.3 Favored 'General case' 0 N--CA 1.498 1.941 0 CA-C-N 118.734 0.697 . . . . 71.45 110.964 -176.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.512 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 2.7 pt? -74.76 -0.9 19.73 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.624 0.77 . . . . 73.21 112.637 173.359 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.512 HG23 ' HB3' ' A' ' 53' ' ' ASN . 42.4 t -63.46 -32.01 55.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 123.82 0.848 . . . . 63.23 112.012 -176.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.453 ' O ' ' HG2' ' A' ' 59' ' ' ARG . 2.1 pp -98.63 28.85 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.564 1.499 0 C-N-CA 124.395 1.078 . . . . 71.23 113.556 -173.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 58.9 mtp180 -48.59 -23.14 0.9 Allowed 'General case' 0 N--CA 1.507 2.406 0 N-CA-C 113.897 1.073 . . . . 71.4 113.897 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.472 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 11.7 mmpt? -48.21 -52.91 18.9 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 124.14 0.976 . . . . 65.41 111.902 169.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.453 ' HG2' ' O ' ' A' ' 56' ' ' ILE . 10.3 ptp180 -80.05 -33.93 38.63 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.975 0.51 . . . . 74.31 112.01 178.314 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -55.8 -52.69 63.09 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.761 0.424 . . . . 55.22 111.433 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.743 HG22 ' HD3' ' A' ' 27' ' ' PRO . 17.1 t -74.41 -38.25 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.088 0 C-N-CA 122.754 0.422 . . . . 52.03 110.416 174.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.09 -40.72 95.97 Favored Glycine 0 CA--C 1.537 1.422 0 N-CA-C 114.833 0.693 . . . . 34.04 114.833 -175.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.2 m -72.71 -35.82 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 122.854 0.462 . . . . 73.12 111.185 178.481 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.471 HD11 HD13 ' A' ' 34' ' ' LEU . 54.7 tp -57.8 -51.8 68.09 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 122.975 0.51 . . . . 75.04 111.127 171.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 87.3 mt -55.27 -39.82 70.27 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 123.764 0.826 . . . . 74.53 111.207 179.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.438 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 22.8 t70 -66.51 -46.64 75.55 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.083 0.953 . . . . 72.51 111.693 179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 71.5 mt -69.74 -34.85 62.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 C-N-CA 123.358 0.663 . . . . 74.32 111.913 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 49.3 mt -72.48 -28.56 62.98 Favored 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.927 0.491 . . . . 74.43 110.436 174.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -69.05 -29.39 67.51 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 122.857 0.463 . . . . 74.21 111.325 171.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.438 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 94.2 mtt180 -65.96 -28.34 68.84 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 122.896 0.479 . . . . 71.25 110.981 174.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 56.3 p -92.0 11.47 25.09 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 123.084 0.553 . . . . 34.32 111.197 171.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 58.52 -119.75 18.95 Favored Glycine 0 C--N 1.351 1.362 0 C-N-CA 124.214 0.911 . . . . 74.52 115.088 172.419 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -72.14 -26.91 62.29 Favored 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 124.01 0.924 . . . . 75.22 111.344 -178.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm -62.54 -57.42 11.21 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.17 0.188 . . . . 73.31 111.002 178.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.66 -35.19 91.71 Favored Glycine 0 C--N 1.346 1.128 0 O-C-N 123.287 0.367 . . . . 61.24 113.105 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -53.94 -64.01 0.96 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.176 0.99 . . . . 63.03 112.706 171.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.436 ' HA ' HD12 ' A' ' 80' ' ' LEU . 93.7 t -63.36 -32.5 56.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 C-N-CA 123.838 0.855 . . . . 52.11 112.12 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.89 -42.0 97.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.362 0.665 . . . . 75.13 111.21 174.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -67.03 -39.41 87.0 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 122.927 0.491 . . . . 72.43 110.409 175.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' A' ' 77' ' ' VAL . 91.3 mt -58.81 -42.73 89.85 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.415 0.686 . . . . 61.01 112.044 174.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.495 ' HG2' ' HB3' ' A' ' 105' ' ' MET . 0.2 OUTLIER -68.35 -39.75 81.75 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.153 0.981 . . . . 72.11 112.554 176.709 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.4 m -62.29 -40.71 97.17 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.734 0.778 . . . . 71.42 109.926 172.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 15.4 tp -75.89 -28.61 58.17 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 114.982 -1.008 . . . . 75.23 110.96 -178.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -64.21 -48.52 75.56 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.189 0.596 . . . . 74.2 110.283 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.0 tt -72.65 -52.36 15.67 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.129 0.572 . . . . 73.32 110.604 178.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -80.06 -49.35 11.89 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 113.691 0.997 . . . . 74.13 113.691 -170.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.603 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.7 m-85 -131.57 74.42 78.18 Favored Pre-proline 0 N--CA 1.496 1.874 0 CA-C-N 119.144 0.884 . . . . 71.13 111.991 179.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -66.8 -12.5 36.22 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.464 2.109 . . . . 73.31 113.218 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -84.14 -38.45 20.67 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.421 0.689 . . . . 71.11 111.835 173.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.603 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -64.24 -37.81 88.81 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 109.285 -0.635 . . . . 71.42 109.285 170.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -65.69 -47.09 76.6 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 115.519 -0.764 . . . . 73.1 110.671 173.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -49.98 -47.52 52.8 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 124.584 1.154 . . . . 71.32 112.373 175.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -78.87 -36.75 41.74 Favored 'General case' 0 CA--C 1.561 1.401 0 N-CA-C 112.793 0.664 . . . . 75.32 112.793 -175.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.405 HG13 ' O ' ' A' ' 90' ' ' LEU . 25.4 m -67.28 -34.81 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 CA-C-N 118.828 0.74 . . . . 74.02 112.618 175.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 62.8 p -82.29 -32.44 29.55 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 122.831 0.453 . . . . 62.14 111.398 176.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 83.93 -3.35 85.87 Favored Glycine 0 CA--C 1.537 1.453 0 CA-C-N 115.806 -0.634 . . . . 42.33 113.083 -178.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.46 -174.34 3.86 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.903 0.881 . . . . 71.11 111.564 -175.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.418 ' HA ' ' HD2' ' A' ' 99' ' ' PRO . 39.7 mm-40 -49.67 126.47 17.97 Favored Pre-proline 0 N--CA 1.489 1.512 0 N-CA-C 114.35 1.241 . . . . 74.21 114.35 -179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' A' ' 98' ' ' GLU . 29.8 Cg_endo -62.38 109.7 0.91 Allowed 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.221 1.947 . . . . 62.32 109.869 162.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -91.21 -11.57 37.87 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.817 0.673 . . . . 62.45 112.817 -167.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.5 mtp180 67.16 52.53 0.85 Allowed 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.325 1.05 . . . . 71.13 110.978 179.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.3 t -82.15 46.0 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.797 0 C-N-CA 124.252 1.021 . . . . 74.43 112.03 -174.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -59.66 3.72 0.05 Allowed 'General case' 0 N--CA 1.503 2.197 0 N-CA-C 115.673 1.731 . . . . 74.41 115.673 -174.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.2 t -56.63 -25.45 53.27 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.646 1.178 . . . . 62.55 112.604 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.495 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 8.2 tpt -61.48 -62.33 1.9 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.521 0.728 . . . . 63.44 111.911 174.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.13 -31.45 53.73 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.44 0 C-N-CA 123.021 0.528 . . . . 63.32 110.97 -179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.406 HG23 ' HG3' ' A' ' 112' ' ' GLU . 35.3 mm -60.53 -44.48 96.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 122.942 0.497 . . . . 74.15 110.936 172.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -72.81 -33.65 66.36 Favored 'General case' 0 CA--C 1.564 1.501 0 C-N-CA 123.147 0.579 . . . . 70.11 112.5 176.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.98 -61.76 1.89 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.607 0.763 . . . . 75.42 112.86 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 47.0 t -89.44 -37.44 14.8 Favored 'General case' 0 N--CA 1.496 1.834 0 C-N-CA 123.641 0.777 . . . . 33.21 111.779 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 122.49 165.48 12.46 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-N 115.665 -0.698 . . . . 70.43 112.181 -173.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.406 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -62.74 -43.86 97.71 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.097 0.559 . . . . 75.44 110.495 176.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.9 p -63.54 -31.69 72.93 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.81 0.844 . . . . 73.22 111.493 175.205 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.25 -58.4 14.75 Favored Glycine 0 C--N 1.352 1.456 0 CA-C-N 116.516 -0.311 . . . . 62.22 113.004 175.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 43.9 tp -68.85 -31.21 70.02 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 122.698 0.399 . . . . 73.44 111.781 177.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 15.6 m -57.42 -47.59 81.36 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.215 0.606 . . . . 73.24 111.046 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -74.11 -34.96 64.11 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.06 0.393 . . . . 74.11 112.06 178.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.569 HD11 ' HG3' ' A' ' 36' ' ' GLN . 43.7 mt -55.59 -53.83 51.56 Favored 'General case' 0 N--CA 1.496 1.825 0 CA-C-O 121.137 0.494 . . . . 61.11 110.698 172.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 78.5 mt -67.55 -32.54 73.39 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.603 0.761 . . . . 61.44 111.887 179.177 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -39.44 94.04 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.852 0.461 . . . . 72.11 111.251 177.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.9 t -77.03 -39.2 50.97 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 112.357 0.503 . . . . 70.43 112.357 172.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -62.15 -32.12 72.69 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 113.186 0.81 . . . . 72.15 113.186 -177.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 32.0 m -67.4 -29.76 46.73 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.125 0 CA-C-O 119.532 -0.27 . . . . 74.53 111.078 173.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.3 mtm -79.67 -36.48 37.64 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.649 0.38 . . . . 64.33 110.552 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -56.98 -50.04 73.88 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 124.212 1.005 . . . . 73.22 110.722 173.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 20.3 mt -68.28 -37.95 81.21 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 114.655 -1.157 . . . . 73.25 112.188 176.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -64.46 -34.19 77.64 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.143 0.577 . . . . 73.23 112.078 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.19 -31.82 30.18 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 122.258 -0.276 . . . . 44.41 110.931 173.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -62.08 -42.76 99.54 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.522 0.729 . . . . 73.31 111.788 176.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 55.1 t -60.85 -43.29 95.24 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 123.543 0.737 . . . . 62.11 110.115 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.555 ' HA ' HG22 ' A' ' 134' ' ' THR . 4.9 tt0 -63.38 -36.79 84.89 Favored 'General case' 0 CA--C 1.555 1.171 0 C-N-CA 123.943 0.897 . . . . 73.41 112.062 178.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.413 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 63.1 m-20 -59.43 -54.06 51.05 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.818 0.447 . . . . 54.32 110.096 174.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.3 mt -68.97 -29.72 67.99 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.22 -0.9 . . . . 75.35 112.234 -176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.555 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.2 t -79.87 -27.13 40.09 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 122.654 0.381 . . . . 74.54 110.566 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -71.58 -41.77 68.59 Favored 'General case' 0 C--N 1.356 0.889 0 C-N-CA 123.193 0.597 . . . . 42.54 110.415 173.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 67.4 mt -65.65 -50.23 65.76 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 115.895 -0.593 . . . . 63.34 109.993 176.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.593 HD11 ' HB2' ' B' ' 136' ' ' LEU . 6.0 mt -48.85 -49.85 37.45 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.297 1.039 . . . . 45.45 113.389 170.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.8 t -62.03 -31.23 71.61 Favored 'General case' 0 N--CA 1.481 1.108 0 N-CA-C 112.315 0.487 . . . . 61.13 112.315 -177.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 78.7 p -113.5 30.06 7.51 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.817 0.847 . . . . 74.34 111.723 176.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 48.7 tttm -86.55 150.31 24.33 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.052 0.541 . . . . 71.41 111.693 -178.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 23.2 m-20 63.28 15.28 8.51 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.867 1.267 . . . . 62.43 111.941 -179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 34.0 t70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 124.214 1.006 . . . . 73.44 111.819 -176.696 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 112.838 -0.105 . . . . 64.41 112.838 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 30.5 t -83.11 73.82 10.04 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 121.576 0.703 . . . . 74.14 109.427 175.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -124.33 140.28 53.1 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.087 0.955 . . . . 72.11 110.426 -176.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.3 m-85 -85.49 -44.19 12.92 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 109.127 -0.694 . . . . 75.11 109.127 170.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.98 128.49 44.58 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.156 0.982 . . . . 72.3 110.344 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 59.6 m-80 -78.23 105.41 9.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 122.843 0.457 . . . . 64.42 110.616 176.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -80.57 130.86 35.38 Favored 'General case' 0 CA--C 1.564 1.507 0 CA-C-O 121.42 0.628 . . . . 63.54 111.307 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -75.83 -15.81 60.18 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.053 0.941 . . . . 72.04 110.421 168.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -56.12 -34.41 66.04 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.936 1.295 . . . . 73.53 113.717 -174.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -72.46 -27.49 62.33 Favored 'General case' 0 CA--C 1.552 1.034 0 N-CA-C 112.888 0.699 . . . . 72.12 112.888 179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 71.4 m95 -58.85 -21.26 56.51 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 113.197 0.814 . . . . 73.23 113.197 173.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 37.7 m -59.71 -26.96 66.04 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.344 0.658 . . . . 63.52 112.355 174.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 58.5 t -66.16 -45.69 89.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.43 0.692 . . . . 75.23 110.571 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 80' ' ' LEU . 78.6 mt -71.09 -29.91 65.89 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.949 0.5 . . . . 75.22 112.047 178.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.485 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 9.9 tp10 -46.89 -56.3 6.56 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.522 1.129 . . . . 75.44 112.881 179.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.0 -16.46 32.65 Favored Glycine 0 CA--C 1.543 1.799 0 N-CA-C 114.953 0.741 . . . . 65.25 114.953 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.473 ' HD1' ' HE3' ' B' ' 93' ' ' LYS . 58.4 m-85 -119.27 4.75 11.24 Favored 'General case' 0 CA--C 1.555 1.169 0 C-N-CA 123.612 0.765 . . . . 74.53 111.91 -177.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' B' ' 15' ' ' GLU . 7.6 ppt_? -64.61 -25.86 68.15 Favored 'General case' 0 N--CA 1.498 1.938 0 CA-C-N 118.758 0.708 . . . . 61.41 112.637 -174.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 15.0 p -62.38 -34.34 63.89 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 C-N-CA 123.09 0.556 . . . . 75.42 111.327 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 9.1 m -81.36 -40.69 23.13 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.429 0.692 . . . . 50.45 110.429 176.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.61 HD23 HD12 ' B' ' 90' ' ' LEU . 93.7 mt -58.72 -40.62 84.26 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.255 0.622 . . . . 75.42 111.767 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.9 p -72.76 -24.78 61.0 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.382 0.673 . . . . 74.33 112.779 179.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 42.2 m -80.83 -44.66 18.13 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.18 0.592 . . . . 62.53 111.526 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.447 HG11 HD21 ' B' ' 90' ' ' LEU . 92.0 t -87.58 -53.12 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 123.584 0.754 . . . . 51.11 112.912 -170.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.508 HD13 ' HA ' ' B' ' 21' ' ' LEU . 2.8 mp -73.26 135.45 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 CA-C-O 121.229 0.538 . . . . 71.23 111.799 -172.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -104.28 116.71 60.88 Favored Pre-proline 0 C--O 1.254 1.321 0 C-N-CA 123.428 0.691 . . . . 71.51 109.534 172.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.582 ' HB3' HD22 ' B' ' 64' ' ' LEU . 16.9 Cg_exo -65.03 -3.45 7.16 Favored 'Trans proline' 0 C--N 1.377 2.046 0 C-N-CA 122.648 2.232 . . . . 75.24 112.173 175.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 3.1 m -77.49 -42.76 34.56 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.154 1.382 . . . . 60.45 110.082 176.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -85.1 -24.48 28.04 Favored 'General case' 0 N--CA 1.492 1.626 0 CA-C-O 120.787 0.327 . . . . 72.33 111.851 -169.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.1 pt -98.3 -1.89 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.4 0.68 . . . . 71.22 111.763 -176.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.435 ' HA ' HD13 ' B' ' 40' ' ' LEU . 54.2 m -50.08 -60.14 5.73 Favored Pre-proline 0 N--CA 1.494 1.729 0 N-CA-C 113.586 0.958 . . . . 74.42 113.586 -179.012 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.68 -27.1 27.26 Favored 'Trans proline' 0 C--N 1.396 3.05 0 C-N-CA 121.562 1.508 . . . . 72.33 112.224 -173.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -67.23 -50.97 58.68 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.174 0.589 . . . . 74.21 109.977 176.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.19 -25.9 68.28 Favored 'General case' 0 CA--C 1.564 1.492 0 C-N-CA 123.523 0.729 . . . . 71.5 112.44 176.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 -64.55 -48.79 73.75 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.186 0.594 . . . . 61.54 110.88 170.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.506 ' HG3' HD11 ' B' ' 118' ' ' LEU . 13.3 mm100 -60.08 -36.83 78.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.587 0.755 . . . . 70.3 111.445 174.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 77.2 m -72.49 -12.08 60.94 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.515 0.726 . . . . 60.21 111.954 174.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 71.57 17.99 5.48 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 124.738 1.215 . . . . 61.23 112.249 172.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 33.7 m -101.46 -39.17 6.52 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 123.314 0.646 . . . . 74.21 111.965 -178.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' B' ' 45' ' ' GLU . 10.6 tt -84.16 127.53 33.98 Favored 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 108.807 -0.812 . . . . 71.24 108.807 178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 24.2 m-80 -89.07 154.51 49.56 Favored Pre-proline 0 CA--C 1.558 1.253 0 C-N-CA 124.131 0.972 . . . . 70.21 111.855 -177.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -64.69 -26.94 60.6 Favored 'Trans proline' 0 C--N 1.382 2.29 0 C-N-CA 122.466 2.11 . . . . 51.55 113.714 -176.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -81.14 -27.84 35.32 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.694 0.398 . . . . 75.15 111.534 173.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -62.91 -60.66 3.16 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.889 0.475 . . . . 54.02 111.536 -179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.4 pt-20 -46.89 -32.75 4.0 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 113.734 1.013 . . . . 70.22 113.734 171.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -74.4 -46.28 41.26 Favored 'General case' 0 N--CA 1.481 1.115 0 N-CA-C 112.201 0.445 . . . . 73.52 112.201 179.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.71 -33.13 68.49 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.56 0.344 . . . . 75.33 111.903 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' B' ' 60' ' ' LYS . 92.7 t -73.43 -42.52 56.61 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.141 0 C-N-CA 123.384 0.674 . . . . 70.14 110.595 177.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -89.0 16.75 6.54 Favored 'General case' 0 N--CA 1.495 1.786 0 C-N-CA 122.792 0.437 . . . . 70.42 112.028 174.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.9 t -79.78 1.21 27.6 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.739 0.816 . . . . 73.21 111.769 170.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.672 ' HB3' ' HE3' ' B' ' 60' ' ' LYS . 6.8 p-10 -72.89 128.29 88.29 Favored Pre-proline 0 CA--C 1.56 1.346 0 C-N-CA 122.605 0.362 . . . . 71.51 111.606 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -80.92 5.73 6.01 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 C-N-CA 122.669 2.246 . . . . 74.43 112.768 167.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.492 ' HB2' HG23 ' B' ' 55' ' ' VAL . 0.3 OUTLIER -165.43 144.86 6.56 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.689 0.796 . . . . 61.14 111.89 -175.835 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.549 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.3 pt? -80.0 1.73 26.44 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 122.92 0.488 . . . . 71.35 112.096 176.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.492 HG23 ' HB2' ' B' ' 53' ' ' ASN . 39.4 t -58.92 -35.12 54.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 123.869 0.867 . . . . 75.11 111.615 179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.403 ' O ' ' HG2' ' B' ' 59' ' ' ARG . 2.2 pp -109.93 24.22 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.251 0 C-N-CA 123.835 0.854 . . . . 64.42 112.352 179.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 33.7 ttp-105 -60.48 -24.15 65.04 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 122.711 0.404 . . . . 63.2 111.224 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 52.1 mmtt -47.48 -57.16 5.69 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.852 1.261 . . . . 72.25 112.782 169.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.403 ' HG2' ' O ' ' B' ' 56' ' ' ILE . 20.9 ptp180 -73.92 -18.5 60.89 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.584 0.353 . . . . 50.24 111.94 178.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.672 ' HE3' ' HB3' ' B' ' 51' ' ' ASP . 74.1 mmtt -72.66 -45.25 59.86 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 122.978 0.511 . . . . 73.44 112.273 176.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.477 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 14.0 t -70.08 -38.72 75.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 N-CA-C 108.968 -0.753 . . . . 64.31 108.968 171.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.1 -45.31 94.09 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 115.217 -0.901 . . . . 73.31 114.148 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.6 m -69.74 -41.94 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 117.337 0.568 . . . . 74.11 110.033 176.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.582 HD22 ' HB3' ' B' ' 27' ' ' PRO . 42.2 tp -52.66 -45.91 66.93 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.419 0.688 . . . . 71.32 111.389 178.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 84.5 mt -57.21 -51.55 68.89 Favored 'General case' 0 CA--C 1.561 1.384 0 C-N-CA 123.298 0.639 . . . . 54.2 111.773 179.283 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -68.76 -29.36 67.73 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 113.165 0.802 . . . . 72.41 113.165 178.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 96.6 mt -78.04 -32.36 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.118 0.567 . . . . 64.02 110.78 179.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 56.2 mt -76.82 -27.86 55.32 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.082 0.553 . . . . 60.31 109.848 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.82 -20.61 65.19 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.456 0.702 . . . . 73.42 111.62 174.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -62.54 -28.42 69.85 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 122.878 0.471 . . . . 74.51 111.73 173.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 68.6 p -96.16 16.01 19.3 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.331 0.652 . . . . 74.33 110.738 173.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.13 -112.85 1.22 Allowed Glycine 0 C--N 1.353 1.5 0 N-CA-C 115.349 0.9 . . . . 31.24 115.349 -179.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -67.96 -30.61 69.94 Favored 'General case' 0 CA--C 1.561 1.391 0 C-N-CA 124.355 1.062 . . . . 73.1 111.787 -175.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 6.7 mmmm -55.86 -60.44 3.46 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.451 0.701 . . . . 60.23 111.448 176.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.25 -36.62 93.66 Favored Glycine 0 C--N 1.346 1.126 0 CA-C-N 116.298 -0.41 . . . . 75.03 113.699 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.455 ' HE2' ' HG ' ' B' ' 14' ' ' LEU . 83.6 t80 -54.88 -64.67 0.76 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.996 0.918 . . . . 73.04 112.557 173.008 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.479 HG12 ' HG2' ' B' ' 105' ' ' MET . 86.2 t -62.65 -31.74 53.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 CA-C-N 115.487 -0.779 . . . . 54.22 111.337 -177.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -68.08 -41.28 82.13 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.329 0.652 . . . . 73.2 112.482 174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 88.7 t80 -62.25 -44.78 95.78 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 122.731 0.412 . . . . 74.22 110.004 176.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.498 HD21 HD21 ' B' ' 14' ' ' LEU . 69.5 mt -65.25 -40.05 93.47 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-N 115.797 -0.638 . . . . 64.53 111.818 176.081 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -57.83 -43.1 85.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.859 1.264 . . . . 75.12 111.439 178.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 50.7 m -69.37 -45.17 69.99 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.387 -0.824 . . . . 61.32 110.635 171.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 20.5 tp -57.57 -46.76 83.57 Favored 'General case' 0 C--O 1.208 -1.119 0 C-N-CA 124.258 1.023 . . . . 62.3 112.453 -171.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.16 -21.0 65.92 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 113.097 0.777 . . . . 71.33 113.097 -178.566 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 5.8 tt -83.44 -48.88 9.86 Favored 'General case' 0 CA--C 1.563 1.443 0 C-N-CA 123.206 0.603 . . . . 71.22 109.622 171.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -86.61 -57.76 2.87 Favored 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 113.742 1.016 . . . . 73.25 113.742 -172.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.41 ' HB3' HD23 ' B' ' 90' ' ' LEU . 67.5 m-85 -125.62 76.06 69.9 Favored Pre-proline 0 N--CA 1.496 1.847 0 O-C-N 121.617 -0.677 . . . . 64.1 111.291 174.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -61.29 -24.21 78.39 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 74.21 113.807 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -67.73 -36.51 80.7 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.107 0.563 . . . . 71.13 111.895 175.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.61 HD12 HD23 ' B' ' 21' ' ' LEU . 3.9 mm? -66.06 -33.4 75.71 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.388 0.675 . . . . 52.22 111.548 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.406 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 85.2 t80 -71.04 -46.88 61.28 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-O 121.16 0.505 . . . . 74.4 110.502 172.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -51.3 -42.04 60.9 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.322 1.049 . . . . 72.55 112.052 177.316 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.585 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -75.37 -43.84 48.16 Favored 'General case' 0 CA--C 1.563 1.461 0 N-CA-C 112.551 0.574 . . . . 65.4 112.551 179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 90' ' ' LEU . 17.9 m -63.56 -34.31 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 CA-C-N 118.811 0.732 . . . . 54.4 112.492 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 76.0 p -86.85 -41.06 14.33 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.877 0.471 . . . . 55.34 112.163 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.6 -1.47 78.89 Favored Glycine 0 CA--C 1.543 1.825 0 CA-C-N 115.998 -0.546 . . . . 15.41 113.3 -173.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.27 178.78 7.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.243 0.617 . . . . 73.23 111.543 177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -57.29 141.14 78.05 Favored Pre-proline 0 N--CA 1.488 1.44 0 C-N-CA 124.862 1.265 . . . . 72.23 112.941 -170.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.406 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 87.4 Cg_exo -50.29 109.69 0.31 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 122.769 2.313 . . . . 64.31 113.251 170.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.04 -33.53 65.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.447 0.699 . . . . 42.12 111.827 -170.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 61.84 52.57 3.4 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 124.622 1.169 . . . . 72.11 110.951 171.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 9.4 t -82.84 51.41 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.488 0 C-N-CA 125.57 1.548 . . . . 70.14 110.914 -177.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.469 ' O ' HG12 ' B' ' 107' ' ' ILE . 83.6 m-85 -51.27 -6.93 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 115.52 1.674 . . . . 71.32 115.52 -177.434 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 47.7 t -55.2 -26.49 39.63 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.671 1.189 . . . . 75.01 112.41 175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . 0.479 ' HG2' HG12 ' B' ' 77' ' ' VAL . 9.1 tpt -63.99 -58.91 5.29 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.202 1.001 . . . . 74.23 112.073 175.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -68.66 -28.31 39.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 122.482 0.313 . . . . 62.44 110.867 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.469 HG12 ' O ' ' B' ' 103' ' ' PHE . 45.3 mm -63.45 -39.45 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 C-N-CA 123.154 0.582 . . . . 65.34 110.791 170.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -72.19 -35.57 68.99 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 123.393 0.677 . . . . 64.34 112.107 173.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.49 -52.84 10.8 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 113.087 0.773 . . . . 65.31 113.087 -174.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' B' ' 36' ' ' GLN . 40.6 t -118.32 0.89 11.78 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.019 0.748 . . . . 72.41 113.019 -174.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.27 168.72 43.72 Favored Glycine 0 N--CA 1.475 1.28 0 C-N-CA 121.917 -0.183 . . . . 30.43 112.91 -173.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.404 ' HG3' HG23 ' B' ' 107' ' ' ILE . 1.8 mp0 -62.59 -44.97 95.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 122.709 0.404 . . . . 51.55 111.835 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 97.5 p -56.29 -32.85 64.97 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.498 0.719 . . . . 54.41 111.891 177.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.54 -58.88 12.02 Favored Glycine 0 C--N 1.352 1.443 0 O-C-N 123.138 0.274 . . . . 73.1 113.248 176.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 62.8 tp -63.76 -39.76 95.04 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.069 0.547 . . . . 74.52 111.844 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 95.3 m -56.9 -45.06 82.88 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.681 0.792 . . . . 73.05 110.688 179.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -81.38 -23.12 37.88 Favored 'General case' 0 N--CA 1.485 1.313 0 N-CA-C 113.241 0.83 . . . . 72.04 113.241 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.506 HD11 ' HG3' ' B' ' 36' ' ' GLN . 72.3 mt -60.27 -50.4 73.79 Favored 'General case' 0 N--CA 1.497 1.915 0 CA-C-O 121.228 0.537 . . . . 60.3 110.298 166.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 87.4 mt -67.65 -41.7 83.39 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.06 0.944 . . . . 74.35 111.412 178.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.481 ' O ' HG22 ' B' ' 123' ' ' VAL . 0.0 OUTLIER -61.75 -47.24 86.11 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.951 0.9 . . . . 74.41 110.756 179.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 6.0 t -67.77 -37.16 81.71 Favored 'General case' 0 N--CA 1.478 0.96 0 O-C-N 122.098 -0.376 . . . . 70.51 110.727 175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -62.23 -34.01 75.67 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.036 0.534 . . . . 73.43 112.107 179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.481 HG22 ' O ' ' B' ' 120' ' ' MET . 4.9 m -70.81 -23.24 23.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.29 0 CA-C-N 118.284 0.493 . . . . 73.42 111.007 175.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.4 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 50.8 mtm -81.51 -37.98 27.01 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 109.795 -0.446 . . . . 65.32 109.795 178.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 6.1 mmmm -53.33 -55.19 26.78 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.675 1.19 . . . . 73.04 110.705 169.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.77 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 24.1 mt -65.31 -41.46 94.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.18 -1.373 . . . . 53.42 112.91 179.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -64.77 -35.57 81.5 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-O 121.052 0.453 . . . . 62.14 111.159 177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -64.18 -50.12 69.37 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.903 0.881 . . . . 74.31 109.472 172.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.484 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 22.3 tptm -60.68 -38.14 83.94 Favored 'General case' 0 CA--C 1.56 1.364 0 C-N-CA 123.974 0.91 . . . . 42.42 111.831 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.449 HG23 ' O ' ' B' ' 126' ' ' LEU . 45.0 t -64.01 -50.28 77.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 72.34 110.288 177.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.604 ' HA ' HG22 ' B' ' 134' ' ' THR . 22.7 pt20 -69.94 -26.51 64.16 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-N 116.499 -0.319 . . . . 70.51 111.453 -177.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 89.2 m-20 -64.67 -47.63 77.73 Favored 'General case' 0 C--N 1.355 0.808 0 N-CA-C 109.724 -0.473 . . . . 72.22 109.724 172.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.484 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.8 mt -70.4 -31.85 69.24 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.348 0.499 . . . . 71.32 112.348 -178.103 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.604 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -76.4 -26.89 56.05 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 117.744 0.247 . . . . 62.33 110.466 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.94 -38.62 86.49 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 122.983 0.513 . . . . 74.32 110.867 169.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.593 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.4 mt -77.26 -24.76 51.07 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.213 0.605 . . . . 71.32 110.834 175.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.49 ' HB2' ' HA ' ' B' ' 134' ' ' THR . 1.3 mt -77.18 -27.22 53.57 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.33 0.652 . . . . 72.41 110.125 174.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.8 t -77.9 -31.64 51.35 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-N 116.07 -0.514 . . . . 74.12 111.285 172.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 89.6 p -159.5 119.81 3.08 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.375 0.67 . . . . 70.11 110.606 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -114.97 -45.99 2.94 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.455 0.702 . . . . 71.24 111.565 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.32 -55.61 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.269 0 CA-C-N 114.441 -1.254 . . . . 51.42 110.624 178.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.1 t70 . . . . . 0 CA--C 1.565 1.525 0 C-N-CA 123.38 0.672 . . . . 72.2 110.303 178.423 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.042 0 CA-C-O 119.751 -0.472 . . . . 74.14 112.492 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.0 p -90.07 131.78 35.76 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 117.562 0.681 . . . . 73.52 110.672 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -76.22 108.72 9.34 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 121.533 0.683 . . . . 72.41 111.045 179.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.35 -67.12 0.77 Allowed 'General case' 0 N--CA 1.482 1.163 0 CA-C-N 115.627 -0.715 . . . . 63.31 109.206 -177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -125.59 -44.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 107.766 -1.198 . . . . 54.42 107.766 165.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 15.6 p-10 -51.97 124.35 12.57 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 124.787 1.235 . . . . 72.04 111.419 171.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -127.62 29.69 5.45 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 111.803 0.298 . . . . 73.33 111.803 -168.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -55.09 -50.38 69.31 Favored 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.294 1.037 . . . . 74.54 113.655 -176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -71.74 -33.57 68.8 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.357 0.663 . . . . 64.43 112.19 -178.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.0 t -70.67 -36.72 73.47 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.227 0.611 . . . . 71.05 112.341 178.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 14.7 m95 -58.1 -16.18 12.19 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.413 1.085 . . . . 75.1 113.336 170.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.4 m -58.17 -21.86 49.07 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 112.899 0.703 . . . . 63.21 112.899 176.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 97.3 t -61.01 -52.86 56.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.321 0.648 . . . . 74.31 110.695 169.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 99.2 mt -75.52 -24.03 56.77 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.106 0.562 . . . . 72.25 112.178 178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 24.9 tp10 -56.46 -49.36 74.86 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.295 1.038 . . . . 72.43 111.553 178.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.29 -4.76 6.83 Favored Glycine 0 CA--C 1.548 2.105 0 N-CA-C 114.823 0.689 . . . . 74.12 114.823 176.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -123.39 -6.8 8.17 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 123.909 0.884 . . . . 71.22 112.57 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 15' ' ' GLU . 6.1 ppt_? -64.98 -23.12 67.12 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 113.376 0.88 . . . . 61.45 113.376 -169.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -60.47 -40.61 84.78 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.039 0.536 . . . . 64.01 111.775 174.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 24.3 m -81.79 -37.93 26.37 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.269 0.628 . . . . 51.5 110.3 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.473 HD23 HD12 ' A' ' 90' ' ' LEU . 94.6 mt -58.14 -42.89 86.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.638 0.375 . . . . 63.34 111.04 177.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.6 p -69.76 -31.73 69.84 Favored 'General case' 0 N--CA 1.482 1.159 0 N-CA-C 112.527 0.566 . . . . 74.21 112.527 178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.711 ' HA ' ' HD2' ' A' ' 58' ' ' LYS . 41.0 t -75.54 -37.6 59.91 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.136 0.574 . . . . 71.13 112.51 -179.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.657 HG11 HD21 ' A' ' 90' ' ' LEU . 64.5 t -88.63 -46.81 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 N-CA-C 112.599 0.592 . . . . 73.13 112.599 -175.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.441 ' HA ' ' CZ ' ' A' ' 87' ' ' TYR . 78.1 mt -73.61 144.04 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.244 0 N-CA-C 112.648 0.61 . . . . 73.41 112.648 -172.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -114.62 110.15 47.31 Favored Pre-proline 0 C--O 1.258 1.55 0 C-N-CA 123.731 0.812 . . . . 72.35 109.653 176.063 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.568 ' O ' HG23 ' A' ' 31' ' ' THR . 52.2 Cg_exo -49.97 -30.95 25.75 Favored 'Trans proline' 0 C--N 1.385 2.464 0 C-N-CA 123.583 2.855 . . . . 65.41 113.968 -173.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.494 ' HA ' HD21 ' A' ' 49' ' ' LEU . 41.8 t -67.22 -31.81 72.43 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 123.541 0.736 . . . . 62.52 112.553 -172.347 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -86.94 -26.18 23.99 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.178 0.436 . . . . 75.22 112.178 -175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -86.55 -13.54 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 N-CA-C 112.552 0.575 . . . . 72.12 112.552 -179.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.568 HG23 ' O ' ' A' ' 27' ' ' PRO . 42.5 p -55.41 -48.6 95.94 Favored Pre-proline 0 N--CA 1.498 1.944 0 N-CA-C 114.469 1.285 . . . . 51.3 114.469 -179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -66.34 -34.61 34.54 Favored 'Trans proline' 0 C--N 1.399 3.185 0 CA-C-N 122.113 1.79 . . . . 64.4 113.135 -176.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -65.87 -53.92 33.38 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.718 -0.475 . . . . 71.14 109.718 175.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -61.65 -27.76 68.9 Favored 'General case' 0 CA--C 1.564 1.507 0 N-CA-C 112.517 0.562 . . . . 74.13 112.517 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -60.68 -52.91 63.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.509 0.724 . . . . 64.22 110.992 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 110' ' ' SER . 11.6 mm100 -63.7 -30.22 71.35 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.041 0.536 . . . . 72.24 112.002 179.355 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 72.7 m -72.28 -11.79 60.86 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.191 0.596 . . . . 74.01 112.099 173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 73.27 10.57 5.1 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.2 1.4 . . . . 73.31 112.112 174.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 23.9 m -92.99 -34.32 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.791 0 C-N-CA 123.466 0.706 . . . . 63.51 111.654 -177.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.495 HD13 ' HA ' ' A' ' 31' ' ' THR . 9.3 tt -90.92 118.08 30.03 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.393 0.677 . . . . 75.12 110.475 176.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.55 156.13 62.19 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 124.805 1.242 . . . . 72.34 111.127 173.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_exo -48.24 -34.97 25.81 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.525 2.817 . . . . 54.23 113.808 175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -54.96 -45.97 74.97 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 124.411 1.084 . . . . 73.22 112.484 176.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.402 ' O ' HG22 ' A' ' 48' ' ' VAL . 6.3 m-20 -64.22 -53.3 51.4 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.962 0.905 . . . . 74.43 111.358 -175.051 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.437 ' HB3' HD21 ' A' ' 40' ' ' LEU . 8.0 pt-20 -61.06 -35.5 77.1 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 115.44 -0.8 . . . . 71.35 111.32 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.68 -42.36 77.94 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 122.672 0.389 . . . . 70.5 111.846 177.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -71.81 -33.33 68.43 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 117.987 0.358 . . . . 74.1 111.52 -177.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.676 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 34.9 m -84.0 -21.27 8.54 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 N-CA-C 112.427 0.529 . . . . 74.12 112.427 178.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.494 HD21 ' HA ' ' A' ' 28' ' ' SER . 4.2 mm? -97.65 8.22 45.04 Favored 'General case' 0 N--CA 1.499 1.992 0 C-N-CA 123.269 0.627 . . . . 71.54 112.095 171.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 22.8 t -84.52 -4.2 58.82 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.847 0.459 . . . . 53.0 110.885 171.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 5.4 p-10 -48.96 130.29 14.99 Favored Pre-proline 0 CA--C 1.568 1.637 0 C-N-CA 124.609 1.163 . . . . 73.24 113.378 -179.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.702 ' HD2' HD11 ' A' ' 56' ' ' ILE . 85.3 Cg_endo -75.47 -7.98 19.16 Favored 'Trans proline' 0 C--N 1.376 1.994 0 C-N-CA 122.801 2.334 . . . . 74.43 113.11 174.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 21.9 p30 -174.17 164.77 4.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.366 1.066 . . . . 71.45 110.532 -175.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -66.04 -14.41 61.66 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.58 0.956 . . . . 73.21 113.58 177.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.7 t -65.59 -57.31 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.043 0 C-N-CA 123.801 0.841 . . . . 63.23 111.968 -171.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.702 HD11 ' HD2' ' A' ' 52' ' ' PRO . 2.6 pp -79.51 3.53 1.82 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 113.108 0.781 . . . . 71.23 113.108 -178.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 61' ' ' VAL . 76.7 mtt180 -57.69 -21.64 41.51 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 112.442 0.534 . . . . 71.4 112.442 173.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.711 ' HD2' ' HA ' ' A' ' 23' ' ' SER . 30.4 mmtp -60.35 -51.75 68.17 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.909 0.884 . . . . 65.41 111.397 173.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -70.29 -22.75 62.81 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 122.196 -0.315 . . . . 74.31 111.145 175.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.676 ' HD3' ' HA ' ' A' ' 48' ' ' VAL . 9.9 mmpt? -70.36 -32.4 70.07 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 122.845 0.458 . . . . 55.22 111.277 176.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.435 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 37.9 t -67.06 -46.22 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.269 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.74 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.21 -42.69 95.47 Favored Glycine 0 C--N 1.354 1.571 0 O-C-N 123.738 0.649 . . . . 34.04 114.078 -178.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.427 ' O ' HG13 ' A' ' 67' ' ' ILE . 26.7 m -69.27 -37.28 75.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 116.584 0.192 . . . . 73.12 110.574 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.409 ' HA ' HD12 ' A' ' 67' ' ' ILE . 39.3 tp -66.13 -37.99 87.06 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 122.555 0.342 . . . . 75.04 111.645 178.214 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.5 mt -63.28 -39.27 94.1 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.144 0.578 . . . . 74.53 111.055 176.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 19.5 t70 -61.66 -41.76 97.98 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.715 0.806 . . . . 72.51 110.772 173.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 63' ' ' VAL . 86.3 mt -63.83 -42.58 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 C-N-CA 123.555 0.742 . . . . 74.32 111.257 175.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.581 HD13 ' HB2' ' A' ' 79' ' ' PHE . 92.6 mt -69.47 -25.12 63.93 Favored 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.194 0.598 . . . . 74.43 111.045 178.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -73.48 -32.92 64.56 Favored 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 123.897 0.879 . . . . 74.21 111.507 169.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.446 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 24.8 mtp180 -67.97 -49.7 60.13 Favored 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 123.374 0.67 . . . . 71.25 111.613 175.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.493 HG22 ' HA ' ' A' ' 68' ' ' LEU . 14.1 t -71.68 -6.33 40.33 Favored 'General case' 0 N--CA 1.493 1.685 0 CA-C-O 121.249 0.547 . . . . 34.32 111.305 173.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 88.22 -142.13 17.27 Favored Glycine 0 C--N 1.351 1.385 0 N-CA-C 115.865 1.106 . . . . 74.52 115.865 161.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 32.1 t60 -68.94 -21.1 64.22 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.674 0.79 . . . . 75.22 110.279 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -58.55 -54.64 44.81 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 115.623 -0.717 . . . . 73.31 110.339 169.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.02 -35.77 92.26 Favored Glycine 0 C--N 1.35 1.356 0 O-C-N 123.704 0.628 . . . . 61.24 113.316 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -54.48 -64.24 0.89 Allowed 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 124.35 1.06 . . . . 63.03 112.103 171.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 81.9 t -56.12 -47.16 80.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 C-N-CA 124.031 0.932 . . . . 52.11 111.765 179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.0 -47.11 86.39 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 115.407 -0.815 . . . . 75.13 112.103 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.581 ' HB2' HD13 ' A' ' 68' ' ' LEU . 65.9 t80 -62.01 -46.73 87.95 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.008 0.523 . . . . 72.43 111.102 178.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HB3' ' HE1' ' A' ' 91' ' ' TYR . 81.5 mt -54.37 -53.68 50.74 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.481 0.712 . . . . 61.01 112.632 177.655 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -78.39 -21.25 49.62 Favored 'General case' 0 CA--C 1.554 1.133 0 N-CA-C 112.343 0.498 . . . . 72.11 112.343 -174.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 72.1 m -66.44 -44.14 83.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 109.834 -0.432 . . . . 71.42 109.834 162.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 27.5 tp -64.07 -41.1 97.46 Favored 'General case' 0 C--O 1.215 -0.763 0 CA-C-N 115.492 -0.776 . . . . 75.23 111.08 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -58.82 -31.85 68.84 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 112.454 0.539 . . . . 74.2 112.454 175.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -72.1 -62.03 1.58 Allowed 'General case' 0 N--CA 1.486 1.33 0 N-CA-C 109.83 -0.433 . . . . 73.32 109.83 173.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -74.78 -55.41 5.86 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.178 0.591 . . . . 74.13 112.4 -169.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.553 ' HB3' HD23 ' A' ' 90' ' ' LEU . 58.5 m-85 -123.37 74.32 51.46 Favored Pre-proline 0 N--CA 1.49 1.533 0 C-N-CA 122.848 0.459 . . . . 71.13 110.5 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.447 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 23.1 Cg_endo -58.6 -37.83 92.46 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.859 2.372 . . . . 73.31 113.992 -172.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.54 ' HG3' HD22 ' A' ' 90' ' ' LEU . 28.7 pt20 -66.61 -32.56 73.97 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 122.787 0.435 . . . . 71.11 111.959 178.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.657 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -65.46 -35.53 81.18 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.847 0.459 . . . . 71.42 110.084 175.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.564 ' HE1' ' HB3' ' A' ' 80' ' ' LEU . 67.0 t80 -70.07 -44.62 68.73 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 122.757 0.423 . . . . 73.1 110.859 173.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.586 ' HE3' ' HD3' ' A' ' 99' ' ' PRO . 39.7 mmtm -55.35 -40.88 71.78 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 113.223 0.823 . . . . 71.32 113.223 176.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.484 ' HD3' HD13 ' A' ' 90' ' ' LEU . 14.4 ptmm? -78.05 -34.44 50.44 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 112.569 0.581 . . . . 75.32 112.569 -178.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.44 HG22 ' HA ' ' A' ' 91' ' ' TYR . 20.1 m -71.64 -31.73 43.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 CA-C-N 118.695 0.679 . . . . 74.02 112.468 175.596 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 75.9 p -86.36 -40.61 15.25 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.056 0.542 . . . . 62.14 111.771 177.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.83 -6.57 79.55 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-N 116.141 -0.481 . . . . 42.33 113.911 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.93 -164.82 1.82 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.543 0.737 . . . . 71.11 111.01 -179.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -63.68 159.46 52.47 Favored Pre-proline 0 CA--C 1.568 1.668 0 C-N-CA 123.968 0.907 . . . . 74.21 111.572 173.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.586 ' HD3' ' HE3' ' A' ' 92' ' ' LYS . 94.8 Cg_endo -77.15 146.94 25.83 Favored 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.276 1.984 . . . . 62.32 114.254 -173.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -77.69 -44.12 28.99 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 122.768 0.427 . . . . 62.45 110.493 173.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.416 ' HG3' ' HB2' ' A' ' 99' ' ' PRO . 54.3 mtt180 60.72 54.02 3.77 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.211 1.004 . . . . 71.13 110.983 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 11.6 t -74.77 49.18 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.683 0 C-N-CA 126.093 1.757 . . . . 74.43 111.601 178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.524 ' O ' HG12 ' A' ' 107' ' ' ILE . 27.7 m-85 -58.41 -13.71 6.01 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.214 1.006 . . . . 74.41 112.74 176.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.8 p -58.25 -22.22 51.49 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 124.137 0.975 . . . . 62.55 111.492 177.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 9.9 tpt -59.08 -62.44 1.88 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.462 1.105 . . . . 63.44 112.013 171.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.477 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.02 -24.16 26.08 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.492 0 C-N-CA 123.135 0.574 . . . . 63.32 110.981 179.692 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.524 HG12 ' O ' ' A' ' 103' ' ' PHE . 29.6 mm -70.45 -35.12 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-O 121.105 0.478 . . . . 74.15 110.737 172.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -74.93 -35.11 62.18 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 122.909 0.484 . . . . 70.11 111.5 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -79.11 -62.23 1.76 Allowed 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.099 0.777 . . . . 75.42 113.099 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 31.5 t -104.02 -2.08 26.54 Favored 'General case' 0 N--CA 1.501 2.083 0 C-N-CA 123.8 0.84 . . . . 33.21 112.614 -176.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 80.36 172.56 45.1 Favored Glycine 0 CA--C 1.532 1.136 0 C-N-CA 121.623 -0.322 . . . . 70.43 113.59 -175.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.51 ' HA ' HD12 ' A' ' 107' ' ' ILE . 40.1 mt-10 -60.61 -37.18 80.57 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.507 0.723 . . . . 75.44 111.905 176.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.6 m -56.28 -45.36 80.2 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.868 0.867 . . . . 73.22 111.969 177.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.0 -57.05 20.94 Favored Glycine 0 C--N 1.351 1.372 0 O-C-N 123.598 0.562 . . . . 62.22 113.596 179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.477 ' HB2' HD12 ' A' ' 106' ' ' ILE . 36.1 tp -66.65 -38.45 86.9 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.175 0.435 . . . . 73.44 112.175 -179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 44.0 m -55.54 -46.24 77.12 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.008 0.523 . . . . 73.24 111.2 175.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -68.63 -39.14 80.92 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.929 0.491 . . . . 74.11 112.007 178.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.469 ' O ' ' HG2' ' A' ' 122' ' ' GLU . 95.5 mt -56.01 -57.43 12.15 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 122.84 0.456 . . . . 61.11 110.553 173.069 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 89.0 mt -60.98 -37.22 81.67 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.26 1.024 . . . . 61.44 112.808 -178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.493 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -67.51 -46.0 74.16 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.411 0.285 . . . . 72.11 110.436 179.329 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 11.6 t -69.2 -27.91 65.91 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.81 -0.556 . . . . 70.43 111.614 177.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 44.9 mm-40 -60.68 -31.22 70.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.043 0.537 . . . . 72.15 112.204 172.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.493 HG22 ' O ' ' A' ' 120' ' ' MET . 1.3 m -67.56 -29.08 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 109.87 -0.418 . . . . 74.53 109.87 173.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 62.6 mtm -81.51 -32.24 32.48 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.495 0.318 . . . . 64.33 110.847 -179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -60.4 -48.42 81.85 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.908 0.861 . . . . 73.22 110.278 173.178 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 17.5 mt -67.28 -39.57 86.05 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 113.979 -1.464 . . . . 73.25 112.451 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 18.6 tp60 -64.24 -39.53 94.14 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 122.919 0.488 . . . . 73.23 111.437 -179.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.419 ' HA ' ' HG2' ' A' ' 131' ' ' GLN . 1.6 mptm? -75.88 -32.27 59.62 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 116.303 -0.408 . . . . 44.41 110.727 175.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.1 tptt -63.09 -34.59 77.92 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.774 0.429 . . . . 73.31 111.185 170.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 126' ' ' LEU . 37.3 t -67.67 -49.12 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.544 0.738 . . . . 62.11 110.722 177.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.617 ' HA ' HG22 ' A' ' 134' ' ' THR . 11.7 pt20 -65.4 -30.08 70.85 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.252 -0.28 . . . . 73.41 111.422 177.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.96 -37.2 81.55 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 123.712 0.805 . . . . 54.32 111.051 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.4 mt -82.75 -48.4 10.88 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.775 -0.648 . . . . 75.35 111.192 -176.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.617 HG22 ' HA ' ' A' ' 131' ' ' GLN . 8.6 t -61.45 -27.34 68.49 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-N 117.739 0.245 . . . . 74.54 111.495 177.592 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.08 -55.18 38.25 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.571 0.748 . . . . 42.54 111.322 171.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.656 ' HB2' HD11 ' B' ' 137' ' ' LEU . 26.2 mt -80.34 -16.84 53.64 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 115.697 -0.683 . . . . 63.34 111.532 -176.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.603 HD11 ' HB2' ' B' ' 136' ' ' LEU . 2.4 tt -77.94 -60.1 2.51 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.887 0.875 . . . . 45.45 108.645 179.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.2 t -59.93 -38.77 83.33 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.003 0.921 . . . . 61.13 112.209 -178.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 t -125.62 86.39 2.53 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.965 0.506 . . . . 74.34 109.892 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 34.1 mttm -77.14 157.01 31.23 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.424 0.69 . . . . 71.41 112.237 175.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 27.6 t70 72.25 0.98 3.78 Favored 'General case' 0 CA--C 1.566 1.593 0 C-N-CA 125.388 1.475 . . . . 62.43 111.967 -174.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 N--CA 1.486 1.335 0 C-N-CA 123.899 0.88 . . . . 73.44 110.413 -179.939 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.854 0 CA-C-O 120.056 -0.302 . . . . 64.41 112.69 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -140.19 120.28 13.72 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-O 121.243 0.545 . . . . 74.14 111.143 178.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -97.6 116.98 30.86 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 124.678 1.191 . . . . 72.11 110.225 173.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -88.56 -29.56 19.95 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 113.663 0.986 . . . . 75.11 113.663 -169.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.85 154.38 30.2 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.721 0.409 . . . . 72.3 111.181 176.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -65.94 105.22 1.27 Allowed 'General case' 0 N--CA 1.484 1.27 0 CA-C-O 120.906 0.384 . . . . 64.42 110.581 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -96.76 89.95 5.1 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.559 0.744 . . . . 63.54 112.764 -169.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -81.17 -21.6 39.57 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.223 -0.898 . . . . 72.04 110.898 169.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -71.05 -34.88 71.67 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 112.899 0.703 . . . . 73.53 112.899 -172.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 54.3 m -66.35 -39.38 89.15 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.982 -0.449 . . . . 72.12 110.726 170.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.405 ' O ' ' HG2' ' B' ' 15' ' ' GLU . 25.8 m95 -58.09 -20.13 37.43 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.707 1.002 . . . . 73.23 113.707 175.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 49.0 m -52.78 -29.42 27.28 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.042 0.756 . . . . 63.52 113.042 177.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -64.97 -38.48 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 124.307 1.043 . . . . 75.23 111.655 176.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.406 HD23 ' HB ' ' B' ' 94' ' ' VAL . 89.8 mt -83.48 -35.01 25.24 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.33 0.652 . . . . 75.22 111.69 177.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' B' ' 11' ' ' TRP . 34.9 mm-40 -47.18 -56.29 6.92 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 124.869 1.267 . . . . 75.44 113.621 -174.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.59 -11.52 29.33 Favored Glycine 0 CA--C 1.542 1.747 0 N-CA-C 115.343 0.897 . . . . 65.25 115.343 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -121.39 2.93 10.28 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 117.748 0.774 . . . . 74.53 111.853 178.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.411 ' O ' HG23 ' B' ' 22' ' ' THR . 18.4 ptt180 -70.85 -23.88 62.41 Favored 'General case' 0 N--CA 1.482 1.172 0 N-CA-C 113.054 0.761 . . . . 61.41 113.054 -174.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.3 p -60.93 -29.29 45.21 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-O 120.957 0.408 . . . . 75.42 111.659 170.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 91.7 m -82.75 -41.04 19.71 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.506 0.722 . . . . 50.45 110.734 172.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.51 HD23 HD12 ' B' ' 90' ' ' LEU . 95.0 mt -60.62 -33.72 73.18 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 123.27 0.628 . . . . 75.42 111.743 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.488 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 38.6 p -71.45 -28.99 64.34 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.648 0.779 . . . . 74.33 112.514 178.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.78 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 32.4 t -82.31 -38.39 24.37 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 122.662 0.385 . . . . 62.53 111.616 178.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.451 HG11 HD21 ' B' ' 90' ' ' LEU . 74.8 t -84.76 -52.25 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 113.946 1.091 . . . . 51.11 113.946 -174.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -77.96 143.43 12.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.746 0 C-N-CA 123.225 0.61 . . . . 71.23 112.044 -170.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.446 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 22.8 t70 -107.33 115.67 59.28 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 123.969 0.908 . . . . 71.51 110.599 179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.586 ' HD3' HG22 ' B' ' 61' ' ' VAL . 76.1 Cg_exo -44.72 -38.76 12.98 Favored 'Trans proline' 0 C--N 1.389 2.673 0 C-N-CA 123.803 3.002 . . . . 75.24 114.546 -178.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.512 ' HB2' HD11 ' B' ' 49' ' ' LEU . 34.0 t -75.66 -23.67 56.28 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 112.589 0.588 . . . . 60.45 112.589 -170.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.446 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 17.3 ptp180 -83.72 -25.79 30.31 Favored 'General case' 0 N--CA 1.492 1.661 0 CA-C-N 118.535 0.607 . . . . 72.33 111.566 -176.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 25.8 pt -96.76 -9.58 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 112.549 0.574 . . . . 71.22 112.549 -177.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.55 HG23 ' O ' ' B' ' 27' ' ' PRO . 16.9 p -53.98 -53.61 56.35 Favored Pre-proline 0 N--CA 1.495 1.785 0 N-CA-C 114.342 1.238 . . . . 74.42 114.342 -176.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.93 -27.69 17.24 Favored 'Trans proline' 0 C--N 1.398 3.17 0 CA-C-N 122.013 1.755 . . . . 72.33 112.858 -176.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 34.0 t80 -62.69 -52.53 62.94 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 123.098 0.559 . . . . 74.21 109.871 172.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.8 -23.0 66.0 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.748 0.819 . . . . 71.5 112.597 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 49.7 mmm-85 -61.16 -52.67 63.87 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 122.729 0.412 . . . . 61.54 110.243 169.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -67.41 -26.89 66.66 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.512 -0.767 . . . . 70.3 112.044 179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 79.8 m -74.48 -14.44 60.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.316 0.647 . . . . 60.21 111.683 170.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.9 mmtt 67.49 30.06 6.96 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.923 1.289 . . . . 61.23 112.099 175.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.401 HG12 ' HB3' ' B' ' 74' ' ' LYS . 28.3 m -111.57 -23.54 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.726 0.811 . . . . 74.21 111.669 176.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.517 HD13 ' HA ' ' B' ' 31' ' ' THR . 9.1 tt -106.73 133.63 51.11 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.61 0.764 . . . . 71.24 109.622 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -107.34 163.31 17.23 Favored Pre-proline 0 CA--C 1.556 1.175 0 C-N-CA 125.15 1.38 . . . . 70.21 110.194 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . 0.414 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 52.5 Cg_exo -55.68 -24.62 46.67 Favored 'Trans proline' 0 C--N 1.387 2.56 0 C-N-CA 122.79 2.326 . . . . 51.55 114.148 178.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.16 -48.47 73.4 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.019 0.928 . . . . 75.15 112.189 174.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.514 ' O ' HG22 ' B' ' 48' ' ' VAL . 50.4 m-20 -62.79 -58.15 8.42 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-N 115.102 -0.953 . . . . 54.02 112.138 -173.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -46.01 -31.88 2.5 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.719 1.007 . . . . 70.22 113.719 173.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 32.3 mm-40 -73.39 -51.37 17.58 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 112.179 0.437 . . . . 73.52 112.179 174.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -69.92 -34.48 73.53 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 113.371 0.878 . . . . 75.33 113.371 -174.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.612 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 18.2 m -71.86 -17.11 19.11 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 113.231 0.826 . . . . 70.14 113.231 174.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 28' ' ' SER . 3.8 mm? -111.35 20.23 17.49 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.902 0.481 . . . . 70.42 111.444 171.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 33.1 t -81.21 0.99 34.15 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 123.11 0.564 . . . . 73.21 112.372 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -81.6 142.56 49.77 Favored Pre-proline 0 CA--C 1.562 1.424 0 C-N-CA 123.415 0.686 . . . . 71.51 110.8 177.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -87.35 5.45 5.63 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.245 2.63 . . . . 74.43 113.432 177.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 23.4 p30 -172.43 159.57 4.62 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.956 0.902 . . . . 61.14 111.254 -171.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . . . . . . . . . 4.2 pp -79.07 25.45 0.29 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 113.845 1.054 . . . . 71.35 113.845 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 96.0 t -76.46 -55.45 11.0 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.349 0 O-C-N 121.712 -0.618 . . . . 75.11 111.231 178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 47.2 pt -95.7 10.14 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 113.518 0.932 . . . . 64.42 113.518 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.491 ' O ' HG23 ' B' ' 61' ' ' VAL . 92.1 mtt180 -64.01 -24.22 67.63 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.735 0.642 . . . . 63.2 112.735 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.78 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 29.9 mmtp -61.51 -59.57 5.02 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.778 0.431 . . . . 72.25 110.926 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -67.22 -19.95 65.62 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-N 116.603 -0.272 . . . . 50.24 111.534 177.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.612 ' HD2' ' HA ' ' B' ' 48' ' ' VAL . 3.5 tppp? -72.76 -30.88 64.5 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.483 0.713 . . . . 73.44 111.392 178.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.586 HG22 ' HD3' ' B' ' 27' ' ' PRO . 21.8 t -68.81 -34.9 67.02 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.919 0 N-CA-C 108.975 -0.75 . . . . 64.31 108.975 168.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -66.59 -32.84 82.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-N 116.394 -0.366 . . . . 73.31 113.886 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 5.2 m -75.59 -32.88 25.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 CA-C-N 116.942 0.371 . . . . 74.11 110.373 173.155 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.483 ' HA ' HD12 ' B' ' 67' ' ' ILE . 51.4 tp -68.59 -42.67 77.89 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.261 0.624 . . . . 71.32 112.072 176.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.7 mt -60.67 -38.85 86.27 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.536 0.734 . . . . 54.2 110.339 174.45 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . 0.591 ' O ' ' HG3' ' B' ' 70' ' ' ARG . 38.8 t70 -62.24 -44.67 96.04 Favored 'General case' 0 CA--C 1.557 1.23 0 CA-C-N 115.584 -0.735 . . . . 72.41 111.213 171.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.483 HD12 ' HA ' ' B' ' 64' ' ' LEU . 91.7 mt -54.46 -50.59 56.81 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 C-N-CA 124.043 0.937 . . . . 64.02 111.505 175.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 66.0 mt -68.55 -28.18 66.74 Favored 'General case' 0 CA--C 1.56 1.349 0 CA-C-N 115.553 -0.749 . . . . 60.31 110.899 179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -72.79 -24.78 60.97 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.552 0.741 . . . . 73.42 111.898 174.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.591 ' HG3' ' O ' ' B' ' 66' ' ' ASP . 84.8 mtt180 -68.12 -18.57 64.68 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.328 0.651 . . . . 74.51 111.906 174.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 43.0 p -96.3 -1.41 47.99 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.156 0.583 . . . . 74.33 111.219 172.676 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 66.1 -122.42 21.33 Favored Glycine 0 C--N 1.349 1.26 0 N-CA-C 114.58 0.592 . . . . 31.24 114.58 -178.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 5.1 t60 -66.45 -26.29 67.14 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 124.361 1.064 . . . . 73.1 111.56 -175.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.401 ' HB3' HG12 ' B' ' 39' ' ' VAL . 8.1 mmmm -55.24 -61.59 2.23 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 124.169 0.988 . . . . 60.23 111.101 174.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.79 -32.84 74.45 Favored Glycine 0 C--N 1.345 1.04 0 CA-C-N 115.262 -0.881 . . . . 75.03 112.967 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.427 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 55.8 t80 -50.74 -66.04 0.45 Allowed 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.466 0.707 . . . . 73.04 112.367 169.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.501 ' HA ' HD12 ' B' ' 80' ' ' LEU . 88.5 t -58.07 -41.89 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 C-N-CA 123.056 0.543 . . . . 54.22 111.973 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . 0.401 ' HB2' ' HG2' ' B' ' 105' ' ' MET . . . -58.01 -43.7 86.81 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 112.639 0.607 . . . . 73.2 112.639 177.055 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 t80 -72.38 -38.54 68.46 Favored 'General case' 0 C--N 1.357 0.912 0 CA-C-O 119.014 -0.517 . . . . 74.22 110.559 178.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.501 HD12 ' HA ' ' B' ' 77' ' ' VAL . 96.5 mt -49.07 -58.49 4.86 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 122.826 0.45 . . . . 64.53 111.84 172.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -74.81 -30.39 61.39 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 113.427 0.899 . . . . 75.12 113.427 -174.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 88.0 p -66.41 -50.59 62.92 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.3 -0.63 . . . . 61.32 109.3 173.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -57.87 -42.48 84.62 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.09 0.956 . . . . 62.3 111.53 175.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -59.3 -33.86 71.59 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.822 1.249 . . . . 71.33 111.487 -179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 9.2 tt -80.42 -48.43 12.9 Favored 'General case' 0 CA--C 1.559 1.325 0 C-N-CA 124.322 1.049 . . . . 71.22 110.838 176.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -81.22 -65.16 1.05 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.577 0.751 . . . . 73.25 112.328 -175.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.447 ' HB3' HD23 ' B' ' 90' ' ' LEU . 80.6 m-85 -112.19 85.26 6.62 Favored Pre-proline 0 N--CA 1.492 1.625 0 C-N-CA 123.192 0.597 . . . . 64.1 111.752 178.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.51 -25.18 48.21 Favored 'Trans proline' 0 C--N 1.379 2.147 0 C-N-CA 122.938 2.425 . . . . 74.21 113.812 -176.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.458 ' HG3' HD22 ' B' ' 90' ' ' LEU . 28.9 pt20 -73.37 -40.94 63.96 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.902 0.481 . . . . 71.13 111.328 175.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.58 HD13 ' HD3' ' B' ' 93' ' ' LYS . 4.4 mm? -62.42 -36.93 83.9 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.925 0.49 . . . . 52.22 110.635 173.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 76.9 t80 -65.64 -48.78 71.03 Favored 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 122.75 0.42 . . . . 74.4 111.227 174.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -51.79 -45.01 63.68 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.132 0.973 . . . . 72.55 111.781 176.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.58 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.0 OUTLIER -74.19 -44.82 51.88 Favored 'General case' 0 CA--C 1.558 1.28 0 N-CA-C 112.682 0.623 . . . . 65.4 112.682 -178.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.507 HG23 HG23 ' B' ' 95' ' ' THR . 32.8 m -62.62 -47.51 92.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 113.415 0.894 . . . . 54.4 113.415 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.507 HG23 HG23 ' B' ' 94' ' ' VAL . 81.0 p -86.62 -28.95 22.92 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.693 0.282 . . . . 55.34 111.639 -176.42 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.9 -1.47 68.2 Favored Glycine 0 CA--C 1.532 1.147 0 CA-C-N 116.011 -0.54 . . . . 15.41 113.318 -178.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -138.8 161.75 36.46 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.399 0.679 . . . . 73.23 111.504 178.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -69.02 159.21 84.0 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 124.36 1.064 . . . . 72.23 112.496 -172.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -48.11 107.81 0.15 Allowed 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 123.399 2.732 . . . . 64.31 114.299 171.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -94.02 -5.72 46.9 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.536 0.734 . . . . 42.12 111.642 179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? 75.84 43.19 0.18 Allowed 'General case' 0 N--CA 1.489 1.525 0 C-N-CA 125.469 1.508 . . . . 72.11 109.433 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 4.3 t -81.04 48.71 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.568 1.647 0 C-N-CA 125.16 1.384 . . . . 70.14 112.309 -173.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.455 ' O ' HG12 ' B' ' 107' ' ' ILE . 33.0 m-85 -65.75 7.97 0.22 Allowed 'General case' 0 CA--C 1.573 1.855 0 N-CA-C 114.366 1.247 . . . . 71.32 114.366 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 34.2 t -44.62 -34.67 2.26 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.536 1.535 . . . . 75.01 115.062 -176.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . 0.401 ' HG2' ' HB2' ' B' ' 78' ' ' ALA . 45.7 tpp -63.82 -55.5 22.52 Favored 'General case' 0 N--CA 1.488 1.475 0 CA-C-N 118.538 0.608 . . . . 74.23 110.763 179.346 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -67.71 -33.05 59.44 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.219 0 C-N-CA 123.164 0.586 . . . . 62.44 110.975 -179.325 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.537 HD12 ' HG2' ' B' ' 112' ' ' GLU . 41.1 mm -63.57 -55.22 24.04 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.249 0 CA-C-O 121.143 0.497 . . . . 65.34 110.765 176.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -58.63 -43.36 89.65 Favored 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 113.139 0.792 . . . . 64.34 113.139 175.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.08 -46.22 24.37 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 113.446 0.906 . . . . 65.31 113.446 -170.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 42.2 t -114.31 -38.03 4.21 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.363 0.665 . . . . 72.41 111.502 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 121.69 164.07 12.15 Favored Glycine 0 N--CA 1.473 1.127 0 CA-C-N 116.639 -0.255 . . . . 30.43 112.957 -173.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.537 ' HG2' HD12 ' B' ' 107' ' ' ILE . 45.2 mt-10 -65.3 -32.15 73.65 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.848 0.459 . . . . 51.55 110.906 172.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.414 ' HA ' ' HB ' ' B' ' 116' ' ' THR . 67.0 m -65.77 -32.39 73.9 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.326 0.651 . . . . 54.41 111.77 171.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.22 -52.77 50.67 Favored Glycine 0 C--N 1.349 1.278 0 N-CA-C 112.192 -0.363 . . . . 73.1 112.192 172.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 45.7 tp -61.83 -34.17 75.48 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.616 0.767 . . . . 74.52 111.867 174.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.414 ' HB ' ' HA ' ' B' ' 113' ' ' SER . 9.4 m -61.32 -44.94 96.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.884 0.874 . . . . 73.05 111.407 175.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -72.95 -34.05 66.27 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 122.308 -0.245 . . . . 72.04 111.324 178.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.432 ' O ' ' HG2' ' B' ' 122' ' ' GLU . 84.5 mt -58.74 -47.35 84.92 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.787 0.435 . . . . 60.3 111.427 171.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.4 ' O ' HG13 ' B' ' 123' ' ' VAL . 92.0 mt -69.25 -38.01 78.23 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.993 0.517 . . . . 74.35 111.075 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.65 -33.89 70.6 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.882 0.873 . . . . 74.41 112.754 173.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 7.7 t -86.21 -33.96 20.61 Favored 'General case' 0 CA--C 1.56 1.332 0 N-CA-C 112.566 0.58 . . . . 70.51 112.566 175.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' B' ' 118' ' ' LEU . 26.6 mm-40 -71.28 -23.78 62.03 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 112.864 0.69 . . . . 73.43 112.864 -179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.4 HG13 ' O ' ' B' ' 119' ' ' LEU . 33.3 m -69.27 -25.59 29.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.027 0 CA-C-O 119.576 -0.25 . . . . 73.42 110.652 169.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 54.8 mtm -79.04 -31.57 44.63 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.267 0.485 . . . . 65.32 110.958 179.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -57.66 -53.35 59.15 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.842 0.83 . . . . 73.04 110.164 172.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.707 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.1 mt -67.63 -31.98 72.37 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 114.099 -1.41 . . . . 53.42 113.198 175.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 19.9 tp60 -63.79 -41.87 97.83 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.267 0.556 . . . . 62.14 110.712 176.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 2.3 mptm? -78.94 -25.88 43.6 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 115.246 -0.888 . . . . 74.31 111.503 176.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.408 ' HB3' ' HA ' ' B' ' 126' ' ' LEU . 53.6 tptt -69.05 -33.22 73.22 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.133 0.573 . . . . 42.42 111.314 173.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.411 HG23 ' O ' ' B' ' 126' ' ' LEU . 50.2 t -64.85 -42.85 95.98 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 122.918 0.487 . . . . 72.34 110.331 171.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.624 ' HA ' HG22 ' B' ' 134' ' ' THR . 16.1 tp60 -62.6 -43.13 99.58 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.784 0.834 . . . . 70.51 111.405 174.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -52.74 -39.72 62.41 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.957 1.303 . . . . 72.22 111.748 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 13.4 mt -87.6 -39.27 15.22 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 115.63 -0.714 . . . . 71.32 111.962 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.624 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.8 t -66.7 -29.54 69.56 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 122.878 0.471 . . . . 62.33 111.361 -175.57 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -67.27 -42.28 84.13 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.61 0.764 . . . . 74.32 111.428 173.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.603 ' HB2' HD11 ' A' ' 137' ' ' LEU . 42.4 mt -81.4 -15.91 53.79 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.11 0.564 . . . . 71.32 111.81 178.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.1 tt -84.38 -49.6 8.56 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 109.081 -0.711 . . . . 72.41 109.081 176.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 35.2 t -63.67 -26.37 68.63 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 122.927 0.491 . . . . 74.12 111.606 176.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 42.2 t -151.28 106.93 3.37 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.462 0.705 . . . . 70.11 109.913 172.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -97.39 -81.59 0.43 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 122.96 0.504 . . . . 71.24 111.538 -176.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -108.27 17.17 22.51 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.027 0.931 . . . . 51.42 111.054 -175.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.568 0.747 . . . . 72.2 111.22 -179.788 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.932 0 CA-C-O 120.23 -0.205 . . . . 74.14 113.014 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.9 t 59.71 -148.39 0.46 Allowed 'General case' 0 N--CA 1.493 1.707 0 C-N-CA 124.267 1.027 . . . . 73.52 110.972 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -71.04 157.52 38.07 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-N 118.499 0.59 . . . . 72.41 110.675 171.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.4 m-85 -72.35 -10.02 59.26 Favored 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 114.135 1.161 . . . . 63.31 114.135 -170.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.93 102.03 0.56 Allowed 'General case' 0 N--CA 1.492 1.638 0 CA-C-N 118.673 0.669 . . . . 54.42 111.898 178.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 54.2 t30 -158.65 103.14 1.73 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 107.758 -1.201 . . . . 72.04 107.758 -179.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -64.11 130.66 44.84 Favored 'General case' 0 CA--C 1.557 1.22 0 N-CA-C 113.303 0.853 . . . . 73.33 113.303 -162.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.6 -34.93 30.67 Favored 'General case' 0 CA--C 1.553 1.062 0 C-N-CA 124.562 1.145 . . . . 74.54 111.638 174.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -52.6 -34.01 48.91 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 114.568 1.322 . . . . 64.43 114.568 -169.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 22.4 p -62.78 -31.25 72.18 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.859 0.689 . . . . 71.05 112.859 -179.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 6.3 m95 -54.1 -19.8 5.55 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 114.386 1.254 . . . . 75.1 114.386 173.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 95.2 p -58.63 -28.31 65.53 Favored 'General case' 0 N--CA 1.496 1.844 0 CA-C-N 118.534 0.606 . . . . 63.21 112.272 177.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.13 -45.72 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 124.168 0.987 . . . . 74.31 111.665 175.301 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 89.1 mt -85.16 -33.56 22.29 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.359 0.664 . . . . 72.25 111.944 179.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.408 ' HA ' ' HG3' ' A' ' 18' ' ' ARG . 14.5 tp10 -51.24 -53.94 30.5 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 125.016 1.327 . . . . 72.43 112.893 -177.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.52 1.08 7.7 Favored Glycine 0 CA--C 1.542 1.721 0 N-CA-C 114.905 0.722 . . . . 74.12 114.905 178.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -120.6 5.81 10.57 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.769 0.827 . . . . 71.22 111.859 175.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.535 ' HG2' HD13 ' A' ' 65' ' ' LEU . 31.2 mtp180 -55.9 -35.64 66.77 Favored 'General case' 0 N--CA 1.5 2.04 0 CA-C-N 118.904 0.775 . . . . 61.45 112.989 -177.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.3 p -57.83 -34.41 48.12 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.671 0 C-N-CA 123.583 0.753 . . . . 64.01 112.147 175.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.5 m -81.43 -43.58 18.72 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.209 1.004 . . . . 51.5 111.123 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.482 ' HA ' HD13 ' A' ' 25' ' ' ILE . 86.1 mt -57.44 -37.75 73.32 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.182 0.993 . . . . 63.34 112.203 -179.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.492 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 69.7 p -75.84 -26.71 57.42 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 115.766 -0.652 . . . . 74.21 112.571 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.8 t -80.41 -35.14 35.58 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.14 0.576 . . . . 71.13 111.566 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.566 HG11 HD21 ' A' ' 90' ' ' LEU . 47.0 t -98.96 -54.25 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 113.927 1.084 . . . . 73.13 113.927 -178.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.482 HD13 ' HA ' ' A' ' 21' ' ' LEU . 3.6 mp -79.12 144.99 10.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 122.9 0.48 . . . . 73.41 110.074 -171.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.732 ' HB2' HH21 ' A' ' 57' ' ' ARG . 13.5 t70 -123.99 124.09 26.04 Favored Pre-proline 0 CA--C 1.556 1.185 0 O-C-N 122.264 -0.272 . . . . 72.35 110.815 175.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.565 ' HD3' HG22 ' A' ' 61' ' ' VAL . 20.7 Cg_endo -57.02 -24.72 59.22 Favored 'Trans proline' 0 C--N 1.381 2.251 0 C-N-CA 123.311 2.674 . . . . 65.41 113.465 -174.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.2 t -67.91 -24.17 65.17 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.537 0.335 . . . . 62.52 111.49 -174.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.29 -28.23 15.69 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 112.003 0.371 . . . . 75.22 112.003 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.436 HG12 ' HA ' ' A' ' 27' ' ' PRO . 35.2 pt -96.07 -13.25 8.24 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 N-CA-C 113.27 0.841 . . . . 72.12 113.27 -173.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.554 HG22 HD11 ' A' ' 40' ' ' LEU . 5.7 p -54.19 -47.74 96.42 Favored Pre-proline 0 N--CA 1.498 1.96 0 N-CA-C 114.309 1.226 . . . . 51.3 114.309 -179.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 57.8 Cg_endo -68.25 -29.19 32.79 Favored 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 121.834 1.689 . . . . 64.4 112.665 178.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 36.0 t80 -62.82 -49.16 76.01 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.139 0.576 . . . . 71.14 109.909 173.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.486 HD13 HD21 ' A' ' 68' ' ' LEU . 76.0 mt -66.95 -25.25 66.25 Favored 'General case' 0 CA--C 1.561 1.387 0 C-N-CA 123.754 0.822 . . . . 74.13 112.473 179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 32.7 mmm-85 -64.93 -48.44 74.12 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 123.063 0.545 . . . . 64.22 110.358 169.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.436 ' HG3' HD11 ' A' ' 118' ' ' LEU . 14.3 mm100 -63.69 -31.02 72.06 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 123.533 0.733 . . . . 72.24 111.75 176.579 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.1 m -75.7 -9.96 59.03 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.701 0.801 . . . . 74.01 112.178 173.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.544 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 72.9 mmtt 71.47 19.78 5.07 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 125.043 1.337 . . . . 73.31 112.818 172.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.51 HG12 ' HB3' ' A' ' 74' ' ' LYS . 29.2 m -102.4 -37.26 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 123.378 0.671 . . . . 63.51 112.099 -177.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.554 HD11 HG22 ' A' ' 31' ' ' THR . 9.3 tt -90.25 126.61 35.89 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.591 0.756 . . . . 75.12 111.273 -177.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 48.3 m-20 -88.4 152.65 50.14 Favored Pre-proline 0 N--CA 1.483 1.2 0 C-N-CA 124.405 1.082 . . . . 72.34 111.096 178.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -58.84 -14.17 21.25 Favored 'Trans proline' 0 C--N 1.381 2.246 0 C-N-CA 123.057 2.505 . . . . 54.23 114.663 178.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -77.74 -42.64 33.53 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.932 0.893 . . . . 73.22 111.419 174.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -62.08 -58.45 7.77 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 115.004 -0.998 . . . . 74.43 111.523 -173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -45.19 -37.55 4.6 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.526 0.936 . . . . 71.35 113.526 173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -73.1 -46.93 48.48 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.809 0.444 . . . . 70.5 112.187 179.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -74.04 -33.38 63.7 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 111.962 0.356 . . . . 74.1 111.962 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 84.6 t -76.36 -38.18 32.37 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.294 0 C-N-CA 124.531 1.132 . . . . 74.12 111.21 178.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -105.79 81.92 1.72 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.976 0.51 . . . . 71.54 110.549 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.4 t -120.03 -30.79 4.61 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.748 0.819 . . . . 53.0 111.049 176.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -92.14 134.14 29.05 Favored Pre-proline 0 CA--C 1.569 1.691 0 C-N-CA 123.605 0.762 . . . . 73.24 111.441 178.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -91.68 40.01 0.31 Allowed 'Trans proline' 0 CA--C 1.563 1.953 0 C-N-CA 123.49 2.793 . . . . 74.43 113.811 -179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.478 ' HB3' HG23 ' A' ' 55' ' ' VAL . 15.7 m120 -152.37 163.95 38.47 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 123.213 0.605 . . . . 71.45 111.653 -167.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.56 ' H ' HD23 ' A' ' 54' ' ' LEU . 1.9 pt? -104.06 25.65 9.72 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.611 0.597 . . . . 73.21 112.611 172.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.478 HG23 ' HB3' ' A' ' 53' ' ' ASN . 75.9 t -70.33 -56.81 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 123.358 0.663 . . . . 63.23 111.521 -179.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -98.71 23.73 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 C-N-CA 123.867 0.867 . . . . 71.23 111.751 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.732 HH21 ' HB2' ' A' ' 26' ' ' ASP . 38.9 ttt-85 -56.67 -24.94 52.23 Favored 'General case' 0 CA--C 1.56 1.357 0 N-CA-C 114.112 1.152 . . . . 71.4 114.112 -171.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.492 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.7 mmtp -59.61 -48.05 83.18 Favored 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 122.94 0.496 . . . . 65.41 111.947 174.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.7 ptm85 -81.52 -26.05 35.43 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.948 -0.47 . . . . 74.31 111.562 176.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.602 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 62.8 tttm -57.64 -49.96 74.75 Favored 'General case' 0 N--CA 1.497 1.922 0 C-N-CA 124.407 1.083 . . . . 55.22 112.393 175.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.565 HG22 ' HD3' ' A' ' 27' ' ' PRO . 11.3 t -77.35 -36.45 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 CA-C-O 120.944 0.402 . . . . 52.03 110.18 174.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.24 -42.5 97.28 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.117 -0.947 . . . . 34.04 114.45 -175.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 17.9 m -64.32 -35.58 74.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 122.504 0.322 . . . . 73.12 111.502 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.449 HD11 HD12 ' A' ' 40' ' ' LEU . 42.6 tp -66.24 -35.87 81.55 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.603 0.361 . . . . 75.04 111.509 177.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.535 HD13 ' HG2' ' A' ' 18' ' ' ARG . 78.2 mt -61.51 -38.61 88.0 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.307 0.643 . . . . 74.53 111.197 176.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -65.23 -38.21 89.68 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.364 0.666 . . . . 72.51 111.628 171.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.517 ' O ' ' HB3' ' A' ' 70' ' ' ARG . 74.5 mt -71.72 -29.83 35.69 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 C-N-CA 124.079 0.952 . . . . 74.32 112.156 179.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.486 HD21 HD13 ' A' ' 34' ' ' LEU . 95.5 mt -82.91 -28.84 29.64 Favored 'General case' 0 CA--C 1.549 0.931 0 O-C-N 121.896 -0.503 . . . . 74.43 110.114 176.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -73.57 -24.13 60.05 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 122.424 0.29 . . . . 74.21 111.203 170.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.517 ' HB3' ' O ' ' A' ' 67' ' ' ILE . 52.0 ttp180 -55.51 -40.68 72.09 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.88 0.872 . . . . 71.25 111.176 169.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 57.6 p -86.92 6.61 31.17 Favored 'General case' 0 CA--C 1.555 1.164 0 CA-C-N 115.453 -0.794 . . . . 34.32 111.262 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 65.49 -129.28 33.67 Favored Glycine 0 C--N 1.353 1.476 0 C-N-CA 123.345 0.498 . . . . 74.52 114.14 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 22.0 t60 -65.43 -27.53 68.59 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.934 0.894 . . . . 75.22 111.038 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.51 ' HB3' HG12 ' A' ' 39' ' ' VAL . 24.8 mmmt -53.12 -62.29 1.75 Allowed 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.073 0.949 . . . . 73.31 112.183 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.98 -31.94 81.06 Favored Glycine 0 C--N 1.352 1.44 0 CA-C-N 116.075 -0.511 . . . . 61.24 113.708 -179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -51.38 -63.08 1.25 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.658 0.783 . . . . 63.03 111.686 169.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.498 ' HA ' HD12 ' A' ' 80' ' ' LEU . 99.5 t -61.26 -40.47 86.13 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.233 0.613 . . . . 52.11 111.849 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -57.71 -43.79 85.45 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.403 0.681 . . . . 75.13 112.002 176.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -72.11 -36.4 69.42 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.035 0.534 . . . . 72.43 111.332 179.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.498 HD12 ' HA ' ' A' ' 77' ' ' VAL . 95.9 mt -54.73 -56.71 16.31 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.108 0.563 . . . . 61.01 111.72 171.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -60.8 -38.86 86.8 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 124.434 1.094 . . . . 72.11 111.707 178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.4 t -57.3 -50.92 71.39 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 115.519 -0.764 . . . . 71.42 111.252 175.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.497 HD23 ' HB3' ' A' ' 90' ' ' LEU . 10.5 mp -72.75 -33.45 66.37 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 112.124 0.416 . . . . 75.23 112.124 178.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.584 ' HG2' ' NH2' ' A' ' 101' ' ' ARG . 22.9 tt0 -59.74 -27.46 66.51 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 121.664 0.745 . . . . 74.2 110.351 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.418 ' HB3' ' HD2' ' A' ' 86' ' ' TYR . 5.4 tt -92.51 -61.3 1.63 Allowed 'General case' 0 CA--C 1.563 1.466 0 C-N-CA 124.851 1.26 . . . . 73.32 110.935 177.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 85' ' ' LEU . 1.5 m-85 -72.57 -51.2 20.78 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 124.525 1.13 . . . . 74.13 112.587 -170.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.418 ' HB3' HD23 ' A' ' 90' ' ' LEU . 87.9 m-85 -127.57 77.57 75.84 Favored Pre-proline 0 N--CA 1.493 1.719 0 C-N-CA 123.412 0.685 . . . . 71.13 110.442 -177.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -60.78 -29.77 88.91 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.978 2.452 . . . . 73.31 113.888 -170.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -73.07 -31.9 64.68 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.54 0.736 . . . . 71.11 112.069 176.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.621 HD13 ' HD3' ' A' ' 93' ' ' LYS . 4.2 mm? -67.89 -42.26 81.48 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.183 0.593 . . . . 71.42 111.191 173.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -62.05 -48.26 81.01 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.094 0.474 . . . . 73.1 110.544 172.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -51.35 -44.8 62.15 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.769 1.228 . . . . 71.32 112.379 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.621 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -77.74 -42.24 34.91 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 112.767 0.655 . . . . 75.32 112.767 -178.528 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 90' ' ' LEU . 22.6 m -64.92 -33.71 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.943 0 CA-C-N 118.7 0.682 . . . . 74.02 112.812 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.406 HG23 HG23 ' A' ' 94' ' ' VAL . 70.7 p -94.44 -30.76 14.28 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 111.894 0.331 . . . . 62.14 111.894 -179.244 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.84 -10.19 75.1 Favored Glycine 0 CA--C 1.537 1.426 0 N-CA-C 113.901 0.32 . . . . 42.33 113.901 -179.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -131.44 170.72 14.3 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.233 0.613 . . . . 71.11 111.07 179.405 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -68.98 150.9 97.48 Favored Pre-proline 0 CA--C 1.555 1.153 0 C-N-CA 123.751 0.82 . . . . 74.21 112.087 -174.514 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -41.69 108.49 0.09 OUTLIER 'Trans proline' 0 C--N 1.386 2.533 0 C-N-CA 123.559 2.839 . . . . 62.32 114.162 171.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.31 -19.12 59.83 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.087 0.555 . . . . 62.45 111.114 -177.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.584 ' NH2' ' HG2' ' A' ' 84' ' ' GLU . 0.8 OUTLIER 78.19 32.42 0.36 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 125.338 1.455 . . . . 71.13 110.249 171.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 12.1 t -85.66 52.32 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.201 0 C-N-CA 124.573 1.149 . . . . 74.43 111.24 -176.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.429 ' O ' HG12 ' A' ' 107' ' ' ILE . 75.7 m-85 -64.4 5.92 0.24 Allowed 'General case' 0 CA--C 1.572 1.826 0 N-CA-C 113.867 1.062 . . . . 74.41 113.867 171.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 38.4 t -58.02 -26.61 62.63 Favored 'General case' 0 CA--C 1.563 1.48 0 C-N-CA 124.53 1.132 . . . . 62.55 114.002 -174.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 4.2 tpt -70.04 -55.66 8.95 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 123.164 0.586 . . . . 63.44 111.233 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.88 -28.3 44.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 122.873 0.469 . . . . 63.32 110.975 176.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.506 HD12 ' HA ' ' A' ' 112' ' ' GLU . 42.7 mm -67.67 -46.21 83.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.387 0 O-C-N 121.807 -0.558 . . . . 74.15 110.913 172.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -66.08 -33.09 75.0 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.119 0.568 . . . . 70.11 111.973 176.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.544 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -80.53 -57.93 3.35 Favored 'General case' 0 CA--C 1.556 1.173 0 C-N-CA 123.891 0.876 . . . . 75.42 112.304 -176.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 40.9 t -95.78 -38.63 10.24 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 124.19 0.996 . . . . 33.21 112.677 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 116.87 160.94 12.09 Favored Glycine 0 N--CA 1.474 1.169 0 CA-C-N 116.315 -0.402 . . . . 70.43 112.258 -172.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.506 ' HA ' HD12 ' A' ' 107' ' ' ILE . 41.6 mt-10 -60.66 -46.64 89.55 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 122.942 0.497 . . . . 75.44 110.741 175.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 47.4 p -57.62 -41.15 80.74 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.163 0.985 . . . . 73.22 111.721 173.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.66 -52.96 49.96 Favored Glycine 0 C--N 1.354 1.58 0 O-C-N 123.129 0.268 . . . . 62.22 113.698 178.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 59.7 tp -63.48 -40.25 96.61 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.524 0.33 . . . . 73.44 111.683 175.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 81.0 m -58.92 -33.99 71.2 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.672 0.789 . . . . 73.24 111.296 176.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -74.41 -38.63 63.01 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.345 0.658 . . . . 74.11 111.44 173.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.436 HD11 ' HG3' ' A' ' 36' ' ' GLN . 90.0 mt -59.49 -37.48 78.39 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.956 0.408 . . . . 61.11 111.998 172.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.57 HD22 ' HA ' ' B' ' 120' ' ' MET . 76.3 mt -69.78 -47.72 61.88 Favored 'General case' 0 C--O 1.219 -0.528 0 C-N-CA 123.789 0.836 . . . . 61.44 110.004 174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 4.0 tpt -56.62 -29.96 62.76 Favored 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.419 1.088 . . . . 72.11 113.039 176.453 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 12.5 t -86.89 -39.37 15.87 Favored 'General case' 0 N--CA 1.483 1.19 0 O-C-N 121.704 -0.622 . . . . 70.43 112.127 173.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -61.39 -35.05 76.42 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 112.605 0.594 . . . . 72.15 112.605 177.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 119' ' ' LEU . 21.1 m -63.52 -25.41 38.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.067 0 CA-C-O 119.641 -0.219 . . . . 74.53 111.392 174.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 67.9 mtm -81.87 -39.67 23.55 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.907 0.483 . . . . 64.33 110.63 178.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.33 -41.77 80.59 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.512 0.725 . . . . 73.22 111.455 171.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 11.3 mt -75.08 -42.54 56.55 Favored 'General case' 0 C--O 1.213 -0.826 0 CA-C-N 114.753 -1.112 . . . . 73.25 111.382 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.463 ' NE2' HD21 ' B' ' 126' ' ' LEU . 9.7 tp-100 -65.92 -28.02 68.62 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.948 0.499 . . . . 73.23 111.321 176.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 12.9 tmtt? -73.26 -45.52 55.35 Favored 'General case' 0 N--CA 1.48 1.053 0 N-CA-C 108.81 -0.811 . . . . 44.41 108.81 173.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.491 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 55.6 tptt -58.66 -37.57 76.29 Favored 'General case' 0 CA--C 1.557 1.231 0 C-N-CA 122.961 0.504 . . . . 73.31 111.275 175.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.4 t -68.07 -45.33 83.61 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.245 0 C-N-CA 123.87 0.868 . . . . 62.11 110.519 177.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.494 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.8 pt20 -65.92 -29.86 70.35 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.965 -0.459 . . . . 73.41 110.972 176.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.497 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 9.1 t70 -69.44 -37.14 77.25 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.511 0.724 . . . . 54.32 110.223 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.543 HD13 ' HB ' ' B' ' 134' ' ' THR . 17.7 mt -82.9 -32.65 27.21 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 116.058 -0.519 . . . . 75.35 111.594 -177.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.494 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.5 t -70.74 -27.78 64.21 Favored 'General case' 0 N--CA 1.482 1.166 0 N-CA-C 110.215 -0.291 . . . . 74.54 110.215 172.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -63.91 -45.94 87.05 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.355 0.662 . . . . 42.54 111.034 171.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.592 ' HB2' HD11 ' B' ' 137' ' ' LEU . 32.8 mt -77.79 -21.59 51.42 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 122.991 0.516 . . . . 63.34 111.898 178.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.6 OUTLIER -78.18 -35.67 48.41 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 108.783 -0.821 . . . . 45.45 108.783 174.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.6 t -79.57 -22.63 43.53 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.27 0.628 . . . . 61.13 111.734 177.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 68.8 m -154.2 96.47 1.94 Allowed 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.104 0.962 . . . . 74.34 110.143 176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.409 ' HD2' HD23 ' B' ' 137' ' ' LEU . 63.9 tttm -99.96 -70.95 0.72 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.615 0.766 . . . . 71.41 111.336 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -98.62 -30.28 12.57 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.058 -0.974 . . . . 62.43 110.727 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 . . . . . 0 CA--C 1.563 1.466 0 C-N-CA 123.422 0.689 . . . . 73.44 110.269 173.342 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.048 0 N-CA-C 112.975 -0.05 . . . . 64.41 112.975 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . 0.691 ' HB2' ' HB2' ' B' ' 5' ' ' GLU . 66.2 m -89.86 154.19 20.07 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.695 0.798 . . . . 74.14 111.706 -179.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -64.97 -61.25 2.27 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.588 1.155 . . . . 72.11 112.339 -172.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 80.6 m-85 -82.87 -26.53 31.49 Favored 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.388 0.675 . . . . 75.11 111.617 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . 0.691 ' HB2' ' HB2' ' B' ' 2' ' ' SER . 41.3 mt-10 -78.56 76.27 5.07 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.589 0.709 . . . . 72.3 111.416 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -137.27 106.16 5.94 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.353 1.461 . . . . 64.42 107.946 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -65.81 123.69 20.45 Favored 'General case' 0 CA--C 1.56 1.361 0 N-CA-C 113.271 0.841 . . . . 63.54 113.271 -167.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -81.39 -13.5 58.22 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 123.426 0.69 . . . . 72.04 111.434 172.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -53.2 -33.67 53.71 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.186 0.994 . . . . 73.53 112.428 -178.111 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 94.4 m -61.79 -43.8 98.14 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 123.365 0.666 . . . . 72.12 112.236 173.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . 0.466 ' HZ3' HD22 ' B' ' 65' ' ' LEU . 72.1 m95 -56.85 -18.73 14.11 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 114.381 1.252 . . . . 73.23 114.381 178.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 83.6 p -56.6 -30.99 63.82 Favored 'General case' 0 N--CA 1.501 2.086 0 CA-C-N 118.725 0.693 . . . . 63.52 112.096 178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -61.86 -62.02 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.625 0.77 . . . . 75.23 110.61 173.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.3 mt -58.42 -33.21 69.42 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.342 0.657 . . . . 75.22 111.742 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' B' ' 18' ' ' ARG . 40.5 tt0 -56.56 -49.9 73.48 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.79 0.836 . . . . 75.44 111.519 176.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.23 -18.32 57.72 Favored Glycine 0 CA--C 1.539 1.56 0 CA-C-N 116.115 -0.493 . . . . 65.25 114.036 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -103.02 3.01 35.68 Favored 'General case' 0 N--CA 1.481 1.117 0 CA-C-O 118.415 -0.803 . . . . 74.53 112.022 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.435 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 91.2 mtt180 -50.31 -42.16 52.22 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 113.33 0.863 . . . . 61.41 113.33 -176.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.6 p -53.06 -38.07 28.58 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.295 0.638 . . . . 75.42 112.666 177.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 34.3 m -86.17 -47.21 9.69 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.774 0.83 . . . . 50.45 111.451 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.573 HD23 HD12 ' B' ' 90' ' ' LEU . 90.0 mt -54.39 -44.63 72.48 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.864 0.866 . . . . 75.42 111.281 179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.405 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 63.1 p -73.61 -25.73 60.46 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 112.663 0.616 . . . . 74.33 112.663 179.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.577 ' HA ' ' HD2' ' B' ' 58' ' ' LYS . 33.4 t -83.56 -26.4 30.11 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 122.922 0.489 . . . . 62.53 112.147 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.676 HG11 HD21 ' B' ' 90' ' ' LEU . 46.8 t -97.77 -58.44 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 N-CA-C 112.835 0.68 . . . . 51.11 112.835 -179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.5 HD13 HD11 ' B' ' 83' ' ' LEU . 82.9 mt -69.59 144.43 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 N-CA-C 114.146 1.165 . . . . 71.23 114.146 -163.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -110.25 110.66 58.24 Favored Pre-proline 0 C--O 1.258 1.504 0 C-N-CA 124.218 1.007 . . . . 71.51 110.351 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.664 ' HD3' HG22 ' B' ' 61' ' ' VAL . 99.6 Cg_exo -45.6 -40.36 18.37 Favored 'Trans proline' 0 C--N 1.389 2.71 0 C-N-CA 123.765 2.977 . . . . 75.24 113.278 174.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.502 ' HA ' HD21 ' B' ' 49' ' ' LEU . 39.1 t -59.79 -33.86 72.27 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.059 0.544 . . . . 60.45 112.166 -173.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -93.76 -26.3 17.04 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 112.687 0.625 . . . . 72.33 112.687 -175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 43.0 pt -88.5 -26.55 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.722 0 N-CA-C 112.569 0.581 . . . . 71.22 112.569 -178.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.515 HG22 HD11 ' B' ' 40' ' ' LEU . 18.4 p -57.51 -42.06 93.82 Favored Pre-proline 0 CA--C 1.568 1.647 0 N-CA-C 114.408 1.262 . . . . 74.42 114.408 -178.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -66.79 -29.49 42.21 Favored 'Trans proline' 0 C--N 1.397 3.087 0 CA-C-N 122.121 1.793 . . . . 72.33 113.424 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.19 -46.9 60.33 Favored 'General case' 0 N--CA 1.483 1.225 0 N-CA-C 109.292 -0.633 . . . . 74.21 109.292 172.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.417 ' HB3' ' HB2' ' B' ' 40' ' ' LEU . 83.7 mt -56.87 -29.78 63.24 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.409 0.684 . . . . 71.5 112.113 176.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -64.5 -52.08 59.66 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.864 0.866 . . . . 61.54 111.622 171.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 14.0 mm100 -62.69 -30.48 71.43 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.182 0.593 . . . . 70.3 112.027 177.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 66.7 m -74.2 -9.88 59.05 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.729 0.812 . . . . 60.21 111.455 174.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt 67.85 26.06 7.7 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 125.239 1.416 . . . . 61.23 112.567 170.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 19.4 m -105.73 -36.63 3.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.097 0.559 . . . . 74.21 111.02 176.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.515 HD11 HG22 ' B' ' 31' ' ' THR . 7.5 tt -89.4 128.19 35.9 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.386 0.674 . . . . 71.24 109.901 -178.103 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -81.71 153.93 70.62 Favored Pre-proline 0 CA--C 1.552 1.022 0 C-N-CA 123.921 0.888 . . . . 70.21 110.396 176.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -55.09 -22.85 33.15 Favored 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.606 2.204 . . . . 51.55 113.281 174.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -69.69 -38.8 77.15 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.854 0.862 . . . . 75.15 112.288 178.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.56 -60.33 3.26 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.215 1.006 . . . . 54.02 110.966 -173.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -51.11 -39.21 55.65 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 114.945 -1.025 . . . . 70.22 112.572 175.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -70.14 -38.53 75.52 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 112.138 0.421 . . . . 73.52 112.138 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -77.97 -29.18 49.64 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 112.659 0.615 . . . . 75.33 112.659 -176.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 m -76.84 -29.85 18.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 CA-C-N 118.093 0.406 . . . . 70.14 111.027 171.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' B' ' 28' ' ' SER . 4.5 mm? -91.1 1.8 56.81 Favored 'General case' 0 N--CA 1.496 1.829 0 C-N-CA 123.188 0.595 . . . . 70.42 112.451 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.5 t -61.61 -34.33 75.47 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 121.438 0.637 . . . . 73.21 111.064 173.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -124.76 81.14 61.57 Favored Pre-proline 0 CA--C 1.565 1.543 0 C-N-CA 124.721 1.208 . . . . 71.51 110.153 174.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.0 Cg_exo -65.91 -5.78 12.81 Favored 'Trans proline' 0 N--CA 1.511 2.54 0 C-N-CA 123.657 2.905 . . . . 74.43 115.484 -170.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -63.53 149.11 47.0 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.432 1.093 . . . . 61.14 112.896 -172.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.573 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.2 pt? -91.39 7.28 41.85 Favored 'General case' 0 CA--C 1.557 1.213 0 N-CA-C 112.521 0.563 . . . . 71.35 112.521 177.189 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 59.0 t -60.53 -48.16 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 CA-C-O 122.257 1.027 . . . . 75.11 110.169 172.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 1.3 pp -110.22 24.69 3.56 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 CA-C-N 113.483 -1.689 . . . . 64.42 111.175 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -53.05 -41.93 65.27 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 125.28 1.432 . . . . 63.2 113.248 -173.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.577 ' HD2' ' HA ' ' B' ' 23' ' ' SER . 28.4 mmtp -68.0 -54.86 15.3 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-N 114.641 -1.163 . . . . 72.25 110.758 -174.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -66.14 -20.78 66.25 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 116.001 -0.545 . . . . 50.24 111.957 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.58 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 22.1 ttmm -64.11 -40.74 96.86 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.77 0.828 . . . . 73.44 111.682 175.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.664 HG22 ' HD3' ' B' ' 27' ' ' PRO . 14.7 t -70.98 -39.38 75.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 CA-C-N 116.166 -0.47 . . . . 64.31 109.919 175.048 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.53 -48.12 87.58 Favored Glycine 0 C--N 1.353 1.494 0 CA-C-N 115.442 -0.799 . . . . 73.31 113.335 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.472 ' O ' HG13 ' B' ' 67' ' ' ILE . 34.3 m -69.28 -33.13 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.92 0 C-N-CA 122.491 0.316 . . . . 74.11 111.313 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.454 ' HA ' HD12 ' B' ' 67' ' ' ILE . 52.9 tp -59.43 -36.96 76.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.953 0.501 . . . . 71.32 111.51 173.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.466 HD22 ' HZ3' ' B' ' 11' ' ' TRP . 91.4 mt -61.24 -49.37 77.39 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.867 0.467 . . . . 54.2 110.654 173.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -51.54 -39.6 58.07 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 123.293 0.637 . . . . 72.41 111.863 174.018 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.472 HG13 ' O ' ' B' ' 63' ' ' VAL . 54.1 mt -64.36 -60.84 2.12 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.108 0 CA-C-N 116.362 -0.381 . . . . 64.02 110.128 177.326 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.436 HD21 HD12 ' B' ' 40' ' ' LEU . 81.8 mt -57.94 -22.9 51.19 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.294 1.038 . . . . 60.31 113.23 -178.257 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -65.21 -20.87 66.64 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 113.481 0.919 . . . . 73.42 113.481 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 13.6 ptm180 -62.61 -26.19 68.48 Favored 'General case' 0 N--CA 1.501 2.119 0 CA-C-N 118.716 0.689 . . . . 74.51 112.442 175.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.593 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 39.3 p -93.89 4.78 53.42 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.267 0.627 . . . . 74.33 111.514 177.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 48.25 -109.27 0.47 Allowed Glycine 0 C--N 1.358 1.786 0 N-CA-C 115.711 1.045 . . . . 31.24 115.711 178.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -69.69 -33.7 72.91 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.734 0.413 . . . . 73.1 110.866 -176.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.593 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 11.1 mmmm -57.38 -56.93 15.42 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.844 0.858 . . . . 60.23 111.373 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.46 -35.42 91.69 Favored Glycine 0 C--N 1.346 1.105 0 CA-C-N 115.973 -0.558 . . . . 75.03 113.442 178.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 78.9 t80 -56.89 -60.54 3.43 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.424 0.69 . . . . 73.04 111.565 173.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.0 t -59.4 -39.81 80.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.182 0.593 . . . . 54.22 111.099 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.55 -31.92 69.15 Favored 'General case' 0 CA--C 1.546 0.812 0 N-CA-C 112.708 0.633 . . . . 73.2 112.708 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -71.76 -41.44 68.4 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 109.843 -0.428 . . . . 74.22 109.843 175.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' B' ' 91' ' ' TYR . 95.9 mt -59.88 -43.02 94.97 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.6 0.76 . . . . 64.53 111.108 173.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -58.62 -56.53 20.97 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 126.467 1.907 . . . . 75.12 111.788 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 22.8 t -61.24 -43.01 99.58 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 115.086 -0.961 . . . . 61.32 111.324 -179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.5 HD11 HD13 ' B' ' 25' ' ' ILE . 7.7 mp -60.23 -47.3 86.56 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.066 0.547 . . . . 62.3 111.245 173.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.27 -28.9 63.39 Favored 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 122.472 0.309 . . . . 71.33 111.275 -172.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 59.0 tp -79.47 -61.81 1.89 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.451 0.7 . . . . 71.22 111.735 167.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -79.41 -52.94 7.41 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 113.103 0.779 . . . . 73.25 113.103 -169.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.505 ' HB3' HD23 ' B' ' 90' ' ' LEU . 87.4 m-85 -117.2 70.43 5.7 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 123.792 0.837 . . . . 64.1 111.233 178.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.69 -26.82 45.53 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.276 1.984 . . . . 74.21 113.348 -171.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -75.37 -26.46 58.52 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 122.798 0.439 . . . . 71.13 111.811 176.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.676 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -69.71 -39.85 76.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.332 0.653 . . . . 52.22 110.284 172.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.444 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 91.8 t80 -65.43 -46.33 80.37 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-O 121.154 0.502 . . . . 74.4 110.654 171.013 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.506 ' HE3' ' HA ' ' B' ' 98' ' ' GLU . 20.7 tptm -54.34 -41.84 69.52 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.569 1.148 . . . . 72.55 112.215 179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 4.4 ptpp? -74.74 -41.57 59.86 Favored 'General case' 0 N--CA 1.486 1.339 0 N-CA-C 112.605 0.594 . . . . 65.4 112.605 177.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.456 HG13 ' O ' ' B' ' 90' ' ' LEU . 18.3 m -66.58 -25.54 35.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 CA-C-N 118.622 0.647 . . . . 54.4 111.97 -179.459 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -84.58 -41.85 16.02 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.915 0.486 . . . . 55.34 111.432 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 87.11 -7.82 79.03 Favored Glycine 0 CA--C 1.54 1.612 0 N-CA-C 114.802 0.681 . . . . 15.41 114.802 -175.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.29 -169.18 2.7 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.694 0.797 . . . . 73.23 110.632 -179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.506 ' HA ' ' HE3' ' B' ' 92' ' ' LYS . 38.4 mt-10 -58.0 148.26 61.1 Favored Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 123.499 0.72 . . . . 72.23 112.379 174.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.444 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 39.1 Cg_endo -63.34 137.59 61.39 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.71 2.273 . . . . 64.31 113.761 -178.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.21 -29.52 68.38 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.398 0.679 . . . . 42.12 110.801 171.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 78.03 43.82 0.09 Allowed 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.992 -1.458 . . . . 72.11 111.073 170.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -76.11 45.44 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.572 1.807 0 C-N-CA 124.36 1.064 . . . . 70.14 113.767 -174.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.659 ' HD2' HD21 ' B' ' 115' ' ' LEU . 7.0 m-85 -61.66 -11.55 12.21 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.85 -0.531 . . . . 71.32 111.673 163.209 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.406 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 78.8 p -62.33 -21.23 65.12 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 124.828 1.251 . . . . 75.01 112.161 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 10.8 tpt -60.05 -58.77 7.11 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.806 0.843 . . . . 74.23 110.684 175.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.461 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -75.84 -25.15 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.415 0 C-N-CA 123.261 0.625 . . . . 62.44 111.222 179.616 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.601 HD12 ' HG2' ' B' ' 112' ' ' GLU . 35.5 mm -58.97 -45.71 91.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.856 -0.527 . . . . 65.34 110.655 168.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -70.01 -43.59 71.05 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 122.804 0.442 . . . . 64.34 111.639 176.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -70.5 -61.57 1.72 Allowed 'General case' 0 N--CA 1.488 1.432 0 N-CA-C 113.416 0.895 . . . . 65.31 113.416 -175.294 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.9 t -101.43 -10.64 20.02 Favored 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 113.043 0.757 . . . . 72.41 113.043 -176.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.8 164.47 30.25 Favored Glycine 0 N--CA 1.484 1.896 0 CA-C-N 117.647 0.203 . . . . 30.43 113.596 -179.273 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . 0.601 ' HG2' HD12 ' B' ' 107' ' ' ILE . 38.7 mt-10 -64.02 -42.28 97.17 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 122.987 0.515 . . . . 51.55 110.615 171.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 85.5 p -59.97 -39.77 86.79 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.478 0.711 . . . . 54.41 110.921 172.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.12 -47.54 90.6 Favored Glycine 0 C--N 1.352 1.425 0 O-C-N 123.296 0.373 . . . . 73.1 113.907 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.659 HD21 ' HD2' ' B' ' 103' ' ' PHE . 37.2 tp -73.87 -25.6 60.12 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.041 0.537 . . . . 74.52 111.933 177.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 91.0 m -62.35 -53.11 59.74 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 109.232 -0.655 . . . . 73.05 109.232 170.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -63.47 -36.83 85.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.475 0.71 . . . . 72.04 111.609 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 1.7 tt -63.54 -63.7 1.1 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.914 0.886 . . . . 60.3 110.153 178.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.507 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 28.9 mt -62.85 -25.16 68.14 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.162 0.585 . . . . 74.35 112.219 -179.641 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.57 ' HA ' HD22 ' A' ' 119' ' ' LEU . 0.0 OUTLIER -72.59 -50.57 24.49 Favored 'General case' 0 N--CA 1.485 1.314 0 CA-C-N 118.223 0.465 . . . . 74.41 110.913 176.808 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -61.93 -35.57 78.79 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 120.612 -0.435 . . . . 70.51 110.51 175.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -62.7 -25.33 68.11 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.292 0.849 . . . . 73.43 113.292 177.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.523 HG22 ' O ' ' B' ' 120' ' ' MET . 2.5 m -71.41 -30.59 40.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 CA-C-N 119.124 0.875 . . . . 73.42 110.201 172.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.403 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 59.8 mtm -83.51 -29.4 27.95 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.231 0.612 . . . . 65.32 110.875 -179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.6 mmmm -63.52 -45.79 89.01 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.638 1.175 . . . . 73.04 109.602 170.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.599 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.3 mt -66.8 -35.39 79.95 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.521 -1.218 . . . . 53.42 112.029 172.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -63.04 -36.58 84.05 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 122.928 0.491 . . . . 62.14 110.595 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.45 ' O ' ' HG3' ' B' ' 131' ' ' GLN . 74.5 mmtt -77.53 -30.94 53.08 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 122.802 0.441 . . . . 74.31 111.11 174.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.421 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 51.2 tptt -69.69 -34.42 73.9 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 123.088 0.555 . . . . 42.42 111.378 177.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 126' ' ' LEU . 49.2 t -64.1 -49.02 83.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 C-N-CA 123.589 0.756 . . . . 72.34 110.221 175.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.715 ' HA ' HG22 ' B' ' 134' ' ' THR . 4.4 pp0? -68.34 -32.14 72.03 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-O 119.57 -0.252 . . . . 70.51 111.08 178.506 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -59.47 -37.25 77.73 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.089 0.956 . . . . 72.22 111.679 176.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 11.4 mt -82.7 -47.75 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-N 116.216 -0.447 . . . . 71.32 110.838 -178.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.715 HG22 ' HA ' ' B' ' 131' ' ' GLN . 6.5 t -64.97 -24.72 67.6 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 111.851 0.315 . . . . 62.33 111.851 179.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.12 -49.01 79.32 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.072 0.949 . . . . 74.32 111.175 175.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.545 ' HB2' HD11 ' A' ' 137' ' ' LEU . 23.7 mt -81.61 -34.43 30.92 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.989 0.516 . . . . 71.32 111.386 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' ' 136' ' ' LEU . 2.3 tt -49.84 -50.13 46.57 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 125.029 1.331 . . . . 72.41 110.404 169.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.2 t -77.34 -26.45 52.09 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.64 0.776 . . . . 74.12 112.438 176.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 31.5 t -98.55 29.74 3.54 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 123.535 0.734 . . . . 70.11 111.319 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 45.2 mttm -61.52 158.95 13.86 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.892 0.701 . . . . 71.24 112.892 171.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 65.78 8.41 5.24 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.921 1.289 . . . . 51.42 112.783 -177.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.426 0 C-N-CA 124.136 0.974 . . . . 72.2 110.118 -178.435 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.25 0 CA-C-O 120.45 -0.083 . . . . 74.14 113.13 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.2 m -88.23 123.2 32.61 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.236 0.615 . . . . 73.52 111.469 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -105.44 -159.89 0.73 Allowed 'General case' 0 CA--C 1.564 1.489 0 C-N-CA 123.773 0.829 . . . . 72.41 110.676 177.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -132.83 -43.27 0.9 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.819 0.848 . . . . 63.31 111.732 179.554 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -69.78 128.4 36.28 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 113.428 0.899 . . . . 54.42 113.428 -167.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -79.42 87.52 5.05 Favored 'General case' 0 N--CA 1.479 1.019 0 CA-C-O 121.514 0.673 . . . . 72.04 109.283 168.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -68.44 113.93 6.42 Favored 'General case' 0 CA--C 1.561 1.4 0 CA-C-N 115.261 -0.881 . . . . 73.33 113.212 -169.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 40.6 m-20 -81.67 -19.37 41.79 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 114.053 1.131 . . . . 74.54 114.053 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.32 -29.42 68.86 Favored 'General case' 0 N--CA 1.501 2.087 0 C-N-CA 123.017 0.527 . . . . 64.43 112.102 -171.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.7 m -67.59 -48.03 68.02 Favored 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 123.639 0.775 . . . . 71.05 111.237 173.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 96.3 m95 -61.08 -20.08 62.18 Favored 'General case' 0 N--CA 1.485 1.29 0 N-CA-C 113.154 0.798 . . . . 75.1 113.154 177.544 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.7 m -61.9 -32.39 72.76 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 123.104 0.562 . . . . 63.21 111.942 172.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 90.7 t -70.97 -34.09 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.475 0 C-N-CA 124.208 1.003 . . . . 74.31 111.607 177.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 80' ' ' LEU . 85.4 mt -85.06 -21.92 29.18 Favored 'General case' 0 N--CA 1.49 1.546 0 N-CA-C 112.356 0.502 . . . . 72.25 112.356 175.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -51.64 -57.74 8.31 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 124.457 1.103 . . . . 72.43 112.956 -171.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -68.51 -7.22 52.71 Favored Glycine 0 CA--C 1.541 1.69 0 N-CA-C 114.135 0.414 . . . . 74.12 114.135 179.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -106.83 -1.85 22.04 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.839 0.855 . . . . 71.22 111.99 175.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -59.5 -36.42 76.03 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 119.083 0.856 . . . . 61.45 112.054 -177.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.1 p -55.11 -33.06 28.87 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.512 0.725 . . . . 64.01 111.751 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.47 HG21 ' NZ ' ' A' ' 93' ' ' LYS . 22.2 m -83.5 -47.51 11.28 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.535 0.734 . . . . 51.5 111.179 177.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.44 ' HA ' HD13 ' A' ' 25' ' ' ILE . 83.0 mt -55.93 -41.57 74.82 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 124.314 1.046 . . . . 63.34 112.03 -177.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.585 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 78.7 p -72.52 -20.61 61.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.91 0.884 . . . . 74.21 113.232 -179.217 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 m -88.85 -45.01 10.07 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.476 0.71 . . . . 71.13 111.644 176.511 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.759 HG11 HD21 ' A' ' 90' ' ' LEU . 95.7 t -88.45 -47.46 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 C-N-CA 123.856 0.862 . . . . 73.13 112.325 -168.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.556 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.7 mp -82.37 142.47 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 122.718 0.407 . . . . 73.41 110.303 179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -121.86 118.24 29.47 Favored Pre-proline 0 C--O 1.251 1.139 0 N-CA-C 108.982 -0.747 . . . . 72.35 108.982 170.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.737 ' HB2' HG11 ' A' ' 48' ' ' VAL . 34.4 Cg_exo -58.2 -16.85 29.62 Favored 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 122.434 2.09 . . . . 65.41 112.841 -179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 26.4 p -67.21 -23.3 65.72 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.738 0.815 . . . . 62.52 111.52 -177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HG3' HG23 ' A' ' 30' ' ' ILE . 13.6 ptp180 -93.01 -32.0 14.67 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-N 117.79 0.268 . . . . 75.22 111.649 175.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.606 HG12 ' HA ' ' A' ' 27' ' ' PRO . 22.2 pt -97.14 -3.47 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 N-CA-C 113.123 0.786 . . . . 72.12 113.123 -173.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.602 HG22 HD11 ' A' ' 40' ' ' LEU . 2.6 p -60.82 -46.41 96.91 Favored Pre-proline 0 N--CA 1.494 1.762 0 CA-C-O 118.177 -0.916 . . . . 51.3 113.403 177.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -65.57 -31.91 49.53 Favored 'Trans proline' 0 C--N 1.396 3.034 0 C-N-CA 121.823 1.682 . . . . 64.4 112.918 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 44.3 t80 -64.32 -58.13 7.39 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.463 0.705 . . . . 71.14 110.962 178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.2 mt -64.25 -22.17 66.85 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.711 1.204 . . . . 74.13 112.726 -179.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.5 mmm-85 -61.17 -51.0 70.89 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.158 0.583 . . . . 64.22 111.106 168.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.482 ' HB2' HD11 ' A' ' 118' ' ' LEU . 14.6 mm100 -67.99 -26.16 65.77 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 122.916 0.486 . . . . 72.24 111.406 177.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -72.93 -14.94 61.57 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 122.843 0.457 . . . . 74.01 111.252 170.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt 66.53 20.51 10.84 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 125.14 1.376 . . . . 73.31 112.74 173.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.533 HG12 ' HB3' ' A' ' 74' ' ' LYS . 21.2 m -100.56 -33.35 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.091 0 C-N-CA 123.571 0.748 . . . . 63.51 110.646 177.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.602 HD11 HG22 ' A' ' 31' ' ' THR . 10.3 tt -89.21 118.12 28.67 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.32 1.048 . . . . 75.12 109.515 175.779 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -86.06 158.33 55.83 Favored Pre-proline 0 CA--C 1.553 1.063 0 C-N-CA 123.624 0.77 . . . . 72.34 111.11 175.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -51.61 -23.93 16.14 Favored 'Trans proline' 0 C--N 1.384 2.4 0 C-N-CA 123.356 2.704 . . . . 54.23 113.932 176.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -61.56 -44.9 96.18 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.298 1.039 . . . . 73.22 112.077 175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.421 ' HB2' HG21 ' A' ' 67' ' ' ILE . 25.9 t70 -64.11 -64.66 0.83 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.502 0.321 . . . . 74.43 111.178 -176.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -49.56 -33.64 15.47 Favored 'General case' 0 CA--C 1.558 1.283 0 N-CA-C 113.601 0.963 . . . . 71.35 113.601 179.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.22 -36.98 46.44 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-N 118.185 0.448 . . . . 70.5 111.927 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -78.34 -24.25 46.61 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 118.894 0.77 . . . . 74.1 112.472 177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.737 HG11 ' HB2' ' A' ' 27' ' ' PRO . 54.3 t -78.33 -54.43 12.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.959 0.904 . . . . 74.12 110.861 175.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -76.29 -1.92 28.98 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 112.766 0.654 . . . . 71.54 112.766 -179.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 45.7 t -60.78 -34.81 75.06 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.168 0.587 . . . . 53.0 111.281 172.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.404 ' HB2' HD11 ' A' ' 56' ' ' ILE . 3.3 p-10 -119.96 87.64 38.96 Favored Pre-proline 0 CA--C 1.562 1.41 0 C-N-CA 124.239 1.016 . . . . 73.24 110.44 173.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -67.62 -9.74 26.42 Favored 'Trans proline' 0 N--CA 1.501 1.915 0 C-N-CA 122.945 2.43 . . . . 74.43 115.02 -173.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -70.3 146.47 50.55 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 113.172 0.804 . . . . 71.45 113.172 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.443 ' H ' HD23 ' A' ' 54' ' ' LEU . 2.7 pt? -76.02 -12.74 60.19 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.481 1.113 . . . . 73.21 112.076 176.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 37.0 t -60.49 -36.46 69.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 123.783 0.833 . . . . 63.23 111.067 -175.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.404 HD11 ' HB2' ' A' ' 51' ' ' ASP . 6.3 pt -116.88 26.61 3.83 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.51 1.124 . . . . 71.23 111.625 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -60.04 -24.7 64.75 Favored 'General case' 0 CA--C 1.565 1.537 0 C-N-CA 123.801 0.84 . . . . 71.4 111.964 174.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 33.9 mmtp -63.29 -50.01 71.78 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.498 0.719 . . . . 65.41 111.896 176.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -72.96 -28.43 62.41 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 120.962 0.41 . . . . 74.31 110.938 176.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.562 ' HG3' HG13 ' A' ' 48' ' ' VAL . 21.2 ttmm -59.63 -44.59 93.43 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 125.157 1.383 . . . . 55.22 113.529 -176.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.658 HG22 ' HD3' ' A' ' 27' ' ' PRO . 31.3 t -78.33 -30.31 15.54 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.023 0 N-CA-C 110.119 -0.326 . . . . 52.03 110.119 176.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.19 -41.71 99.58 Favored Glycine 0 CA--C 1.539 1.591 0 CA-C-N 116.276 -0.42 . . . . 34.04 113.645 178.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 35.4 m -71.4 -35.96 59.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.249 0.62 . . . . 73.12 111.556 177.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 36.0 tp -52.67 -49.99 64.16 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.673 0.789 . . . . 75.04 111.254 170.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 89.6 mt -52.7 -37.07 58.4 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.389 -0.823 . . . . 74.53 111.745 178.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.459 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 24.7 m-20 -60.99 -50.48 73.21 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.256 0.622 . . . . 72.51 112.276 176.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.421 HG21 ' HB2' ' A' ' 44' ' ' ASP . 2.4 mp -61.41 -36.21 71.59 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 CA-C-O 121.146 0.498 . . . . 74.32 110.536 177.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' ' 79' ' ' PHE . 86.2 mt -69.04 -33.7 74.02 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-N 116.001 -0.545 . . . . 74.43 111.575 175.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 65' ' ' LEU . 76.5 mt-30 -72.75 -28.92 62.92 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 123.695 0.798 . . . . 74.21 111.901 175.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 66' ' ' ASP . 56.1 mtp180 -61.74 -25.07 67.22 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 122.974 0.509 . . . . 71.25 111.646 174.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 81.5 p -99.32 1.53 44.58 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.722 0.809 . . . . 34.32 111.788 175.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.19 -123.42 14.44 Favored Glycine 0 C--N 1.354 1.574 0 N-CA-C 115.017 0.767 . . . . 74.52 115.017 178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -70.19 -23.17 62.91 Favored 'General case' 0 CA--C 1.558 1.27 0 C-N-CA 124.199 0.999 . . . . 75.22 111.327 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.533 ' HB3' HG12 ' A' ' 39' ' ' VAL . 31.8 mmmt -53.52 -61.16 2.48 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.157 0.983 . . . . 73.31 111.542 175.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.98 -32.85 85.58 Favored Glycine 0 C--N 1.348 1.24 0 CA-C-N 115.383 -0.826 . . . . 61.24 113.444 -178.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -57.37 -62.68 1.6 Allowed 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.499 0.719 . . . . 63.03 112.153 173.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.13 -42.78 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 O-C-N 123.616 0.573 . . . . 52.11 111.017 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.509 ' HB2' ' HG2' ' A' ' 105' ' ' MET . . . -64.9 -39.36 93.41 Favored 'General case' 0 CA--C 1.555 1.151 0 N-CA-C 112.874 0.694 . . . . 75.13 112.874 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.524 ' HB2' HD13 ' A' ' 68' ' ' LEU . 87.2 t80 -66.03 -47.13 75.43 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 122.925 0.49 . . . . 72.43 110.428 177.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.487 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 93.2 mt -57.31 -49.16 76.98 Favored 'General case' 0 N--CA 1.478 0.962 0 CA-C-N 115.656 -0.702 . . . . 61.01 111.106 175.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -54.75 -42.35 71.54 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 126.173 1.789 . . . . 72.11 112.314 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 69.4 m -57.4 -51.4 69.56 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.191 0.597 . . . . 71.42 110.242 171.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.469 HD11 HG12 ' A' ' 25' ' ' ILE . 8.4 mp -58.64 -38.7 78.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.792 0.437 . . . . 75.23 111.928 177.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 38.7 mt-10 -63.19 -21.1 65.99 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.042 0.537 . . . . 74.2 112.169 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -89.26 -56.99 3.05 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 123.725 0.81 . . . . 73.32 110.393 171.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -84.27 -64.56 1.14 Allowed 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.148 0.979 . . . . 74.13 113.012 -171.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.636 ' HB3' HD23 ' A' ' 90' ' ' LEU . 96.5 m-85 -116.96 76.88 8.39 Favored Pre-proline 0 N--CA 1.499 1.992 0 C-N-CA 123.581 0.752 . . . . 71.13 111.474 -174.336 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -74.05 -23.83 15.59 Favored 'Trans proline' 0 C--N 1.379 2.152 0 C-N-CA 122.613 2.209 . . . . 73.31 114.175 -168.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.49 ' HG3' HD22 ' A' ' 90' ' ' LEU . 16.3 pt20 -65.57 -34.56 78.53 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.274 0.63 . . . . 71.11 111.768 174.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.759 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -60.51 -51.68 68.42 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.8 0.84 . . . . 71.42 110.011 175.3 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.427 ' HA ' HG22 ' A' ' 94' ' ' VAL . 79.2 t80 -57.92 -47.38 83.03 Favored 'General case' 0 CA--C 1.554 1.1 0 O-C-N 123.554 0.534 . . . . 73.1 111.128 175.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.595 ' HG2' ' HA ' ' A' ' 98' ' ' GLU . 8.4 tmtt? -47.58 -51.15 22.05 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.615 1.166 . . . . 71.32 111.27 178.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.47 ' NZ ' HG21 ' A' ' 20' ' ' THR . 63.7 pttt -80.93 -35.92 31.73 Favored 'General case' 0 CA--C 1.559 1.321 0 N-CA-C 114.076 1.139 . . . . 75.32 114.076 -176.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.473 HG13 ' O ' ' A' ' 90' ' ' LEU . 16.3 m -62.33 -37.02 77.6 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 CA-C-N 119.238 0.927 . . . . 74.02 111.863 176.624 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 66.5 p -91.24 -31.36 16.17 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.822 0.449 . . . . 62.14 112.018 -179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.66 -9.75 52.53 Favored Glycine 0 N--CA 1.477 1.382 0 CA-C-N 116.104 -0.498 . . . . 42.33 113.544 -178.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.446 ' O ' ' HA ' ' A' ' 92' ' ' LYS . 0.2 OUTLIER -140.41 162.56 35.04 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.623 0.769 . . . . 71.11 110.818 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.595 ' HA ' ' HG2' ' A' ' 92' ' ' LYS . 11.9 pt-20 -61.56 156.43 53.58 Favored Pre-proline 0 CA--C 1.561 1.395 0 C-N-CA 124.171 0.989 . . . . 74.21 112.892 -176.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_exo -37.35 111.38 0.09 OUTLIER 'Trans proline' 0 C--N 1.39 2.722 0 C-N-CA 124.175 3.25 . . . . 62.32 116.187 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -73.92 -25.88 60.22 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.09 -0.959 . . . . 62.45 110.492 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 82.11 52.4 0.02 OUTLIER 'General case' 0 C--O 1.242 0.692 0 C-N-CA 127.329 2.252 . . . . 71.13 109.54 174.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.73 47.99 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.69 0 C-N-CA 124.031 0.932 . . . . 74.43 112.242 -179.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.424 ' O ' HG12 ' A' ' 107' ' ' ILE . 89.1 m-85 -67.24 2.11 1.79 Allowed 'General case' 0 CA--C 1.565 1.542 0 C-N-CA 124.292 1.037 . . . . 74.41 112.911 174.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 42.8 t -46.69 -35.29 5.89 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.872 1.669 . . . . 62.55 113.642 174.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.509 ' HG2' ' HB2' ' A' ' 78' ' ' ALA . 42.5 tpp -65.76 -62.31 1.58 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.017 0.527 . . . . 63.44 111.46 -177.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.476 HG21 HD13 ' A' ' 115' ' ' LEU . 0.1 OUTLIER -66.58 -34.3 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.475 0 C-N-CA 123.832 0.853 . . . . 63.32 110.772 -177.978 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.424 HG12 ' O ' ' A' ' 103' ' ' PHE . 44.5 mm -62.82 -47.06 94.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 O-C-N 121.798 -0.564 . . . . 74.15 110.692 174.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -65.31 -36.45 84.09 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 112.386 0.513 . . . . 70.11 112.386 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -78.43 -60.06 2.53 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 113.099 0.778 . . . . 75.42 113.099 -172.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 32.7 t -108.75 -6.3 15.96 Favored 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 123.643 0.777 . . . . 33.21 112.252 -175.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.84 166.79 30.58 Favored Glycine 0 N--CA 1.476 1.328 0 N-CA-C 113.717 0.247 . . . . 70.43 113.717 -179.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.57 -46.08 89.97 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.037 0.535 . . . . 75.44 110.316 171.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 61.3 p -58.44 -32.09 68.36 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.155 0.982 . . . . 73.22 112.256 174.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.7 -54.33 34.54 Favored Glycine 0 C--N 1.355 1.599 0 CA-C-O 120.919 0.177 . . . . 62.22 113.122 174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.476 HD13 HG21 ' A' ' 106' ' ' ILE . 51.8 tp -63.31 -35.99 82.19 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.666 0.386 . . . . 73.44 111.272 175.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 51.6 m -60.23 -40.94 92.0 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.6 0.76 . . . . 73.24 110.782 175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -68.21 -39.85 82.3 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.356 0.663 . . . . 74.11 112.168 174.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.482 HD11 ' HB2' ' A' ' 36' ' ' GLN . 85.3 mt -62.19 -45.71 92.19 Favored 'General case' 0 N--CA 1.498 1.972 0 CA-C-O 121.224 0.535 . . . . 61.11 111.881 175.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.9 mt -66.14 -42.63 88.84 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.113 0.965 . . . . 61.44 110.879 176.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.469 ' HG2' ' HD2' ' B' ' 101' ' ' ARG . 9.2 tpt -60.8 -45.12 95.63 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.016 0.926 . . . . 72.11 111.946 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -68.7 -39.88 80.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 120.898 -0.321 . . . . 70.43 110.797 173.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.7 -33.7 76.23 Favored 'General case' 0 N--CA 1.48 1.049 0 N-CA-C 112.473 0.546 . . . . 72.15 112.473 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 119' ' ' LEU . 10.2 m -68.77 -24.74 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 CA-C-N 118.029 0.377 . . . . 74.53 110.779 175.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.407 ' HB2' ' HE3' ' A' ' 124' ' ' MET . 54.1 mtm -80.6 -45.03 17.99 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 109.416 -0.587 . . . . 64.33 109.416 177.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.451 ' HE2' ' HB3' ' A' ' 125' ' ' LYS . 40.2 mtpt -51.57 -50.72 59.54 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.39 1.076 . . . . 73.22 110.921 173.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 24.5 mt -64.53 -41.62 96.27 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 114.747 -1.115 . . . . 73.25 112.505 173.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 8.8 tp-100 -57.69 -38.07 74.54 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 118.391 0.542 . . . . 73.23 111.873 176.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.01 -35.11 57.32 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 122.996 0.518 . . . . 44.41 110.572 175.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.549 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 52.1 tptt -64.97 -29.78 70.73 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 122.721 0.408 . . . . 73.31 111.044 175.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 126' ' ' LEU . 51.7 t -68.84 -48.76 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 123.468 0.707 . . . . 62.11 110.416 175.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.701 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.7 pt20 -67.39 -30.42 70.2 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 116.783 -0.189 . . . . 73.41 110.986 178.139 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -59.57 -34.56 72.85 Favored 'General case' 0 C--N 1.356 0.858 0 C-N-CA 124.666 1.186 . . . . 54.32 110.556 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 25.6 mt -86.62 -51.02 6.4 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.68 -0.691 . . . . 75.35 111.698 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.701 HG22 ' HA ' ' A' ' 131' ' ' GLN . 10.9 t -61.72 -28.82 69.69 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 112.037 0.384 . . . . 74.54 112.037 -176.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.67 -47.28 84.35 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.341 0.656 . . . . 42.54 111.463 173.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.1 mt -80.27 -20.59 44.1 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.724 0.81 . . . . 63.34 111.059 -179.466 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.439 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -75.35 -58.79 3.07 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 124.47 1.108 . . . . 45.45 108.658 -179.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 44.3 t -54.91 -37.61 66.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.613 1.165 . . . . 61.13 112.855 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 43.3 t -125.55 98.78 5.73 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.487 0.715 . . . . 74.34 110.696 -174.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.58 ' HE2' HD23 ' B' ' 137' ' ' LEU . 91.6 mttt -108.22 132.34 53.75 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.18 0.592 . . . . 71.41 111.775 177.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 37.9 t70 176.62 -31.29 0.0 OUTLIER 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 125.158 1.383 . . . . 62.43 110.354 -173.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 . . . . . 0 N--CA 1.49 1.559 0 C-N-CA 124.033 0.933 . . . . 73.44 111.921 -172.58 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.441 -0.264 . . . . 64.41 112.441 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.6 m -87.96 106.55 18.2 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.618 0.767 . . . . 74.14 109.879 178.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -65.8 145.64 55.73 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.153 0.581 . . . . 72.11 111.043 178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -93.73 -56.26 2.96 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 122.933 0.493 . . . . 75.11 111.956 -170.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.31 161.77 21.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 124.016 0.927 . . . . 72.3 112.704 -176.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.447 HD21 ' HB3' ' B' ' 69' ' ' GLN . 54.6 t-20 -72.37 95.01 1.69 Allowed 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.593 -0.73 . . . . 64.42 109.083 171.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 -79.74 83.48 5.69 Favored 'General case' 0 CA--C 1.563 1.451 0 CA-C-O 122.019 0.914 . . . . 63.54 110.795 177.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -58.47 -34.48 70.93 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.738 1.215 . . . . 72.04 112.954 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -66.71 -23.35 66.1 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 112.441 0.534 . . . . 73.53 112.441 -175.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 86.6 m -69.91 -54.61 12.61 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 122.801 0.44 . . . . 72.12 109.845 168.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 82.2 m95 -56.93 -19.03 15.64 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.453 1.101 . . . . 73.23 113.942 175.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 69.0 m -59.88 -22.88 62.93 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.878 0.871 . . . . 63.52 112.57 175.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 88.2 t -67.42 -43.7 87.41 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 C-N-CA 123.652 0.781 . . . . 75.23 110.983 171.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.402 HD23 ' HB ' ' B' ' 94' ' ' VAL . 93.1 mt -79.38 -27.52 41.9 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.604 0.762 . . . . 75.22 112.755 -179.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -48.56 -56.94 7.0 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 124.609 1.163 . . . . 75.44 112.859 -169.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.66 -14.06 48.74 Favored Glycine 0 CA--C 1.538 1.471 0 N-CA-C 114.773 0.669 . . . . 65.25 114.773 -177.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 80.2 m-85 -104.22 -8.97 18.96 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.416 0.686 . . . . 74.53 111.837 179.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 79.8 mtm180 -58.35 -32.96 69.04 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 112.715 0.635 . . . . 61.41 112.715 -175.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 7.8 p -53.93 -35.94 29.47 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.471 0 C-N-CA 123.577 0.751 . . . . 75.42 111.892 174.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 21.3 m -91.94 -36.39 13.47 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.033 0.933 . . . . 50.45 111.459 178.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.442 ' HA ' HD13 ' B' ' 25' ' ' ILE . 95.4 mt -58.55 -34.52 71.11 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.215 0.606 . . . . 75.42 111.196 177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 44.5 p -72.57 -28.76 63.01 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 112.964 0.728 . . . . 74.33 112.964 176.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . 0.463 ' HB3' ' HE2' ' B' ' 58' ' ' LYS . 73.6 p -89.42 -26.79 20.81 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 112.718 0.636 . . . . 62.53 112.718 179.827 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.57 -50.61 11.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 N-CA-C 112.624 0.601 . . . . 51.11 112.624 -175.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.1 mp -79.7 140.56 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.156 0.582 . . . . 71.23 111.679 -174.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -111.5 107.58 56.81 Favored Pre-proline 0 CA--C 1.556 1.191 0 C-N-CA 123.665 0.786 . . . . 71.51 110.874 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.654 ' HD3' HG22 ' B' ' 61' ' ' VAL . 55.9 Cg_exo -52.82 -29.33 42.43 Favored 'Trans proline' 0 C--N 1.383 2.353 0 C-N-CA 123.042 2.494 . . . . 75.24 113.023 178.046 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 88.3 p -67.65 -28.21 67.52 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.158 0.583 . . . . 60.45 111.247 -174.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -94.02 -22.03 18.79 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 112.029 0.381 . . . . 72.33 112.029 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.453 HD11 HD21 ' B' ' 64' ' ' LEU . 22.6 pt -100.16 -2.92 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 N-CA-C 112.131 0.419 . . . . 71.22 112.131 -179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.619 HG22 HD11 ' B' ' 40' ' ' LEU . 3.7 p -57.76 -48.71 96.7 Favored Pre-proline 0 CA--C 1.57 1.749 0 CA-C-O 117.966 -1.016 . . . . 74.42 113.374 175.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -66.89 -29.4 41.56 Favored 'Trans proline' 0 C--N 1.397 3.125 0 C-N-CA 121.867 1.712 . . . . 72.33 112.761 179.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -67.69 -55.42 13.25 Favored 'General case' 0 CA--C 1.556 1.175 0 CA-C-N 115.676 -0.693 . . . . 74.21 111.212 177.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 94.9 mt -65.45 -18.74 65.55 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.766 0.827 . . . . 71.5 113.027 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.459 ' HG2' ' O ' ' B' ' 31' ' ' THR . 24.1 mmm-85 -53.19 -53.49 49.91 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 121.553 0.692 . . . . 61.54 110.696 165.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.498 ' HB2' HD11 ' B' ' 118' ' ' LEU . 10.3 mm100 -74.2 -19.19 60.62 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.071 -0.968 . . . . 70.3 112.25 -176.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.7 m -76.48 -15.22 59.95 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.851 0.46 . . . . 60.21 110.973 168.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.535 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 34.1 mmtp 72.13 19.94 4.4 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.447 1.499 . . . . 61.23 112.584 174.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.418 HG12 ' HB3' ' B' ' 74' ' ' LYS . 33.7 m -105.67 -35.95 3.48 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.192 0 C-N-CA 123.575 0.75 . . . . 74.21 112.697 -175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.619 HD11 HG22 ' B' ' 31' ' ' THR . 9.0 tt -80.33 115.05 19.66 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.197 0.599 . . . . 71.24 111.574 -177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -77.34 160.5 75.3 Favored Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 123.909 0.884 . . . . 70.21 112.519 176.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.11 -24.61 67.16 Favored 'Trans proline' 0 C--N 1.39 2.733 0 C-N-CA 123.158 2.572 . . . . 51.55 113.133 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.58 -38.27 90.5 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 124.861 1.264 . . . . 75.15 111.85 176.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.446 ' O ' HG22 ' B' ' 48' ' ' VAL . 27.2 t70 -68.15 -63.31 1.09 Allowed 'General case' 0 C--N 1.35 0.611 0 CA-C-N 116.667 -0.242 . . . . 54.02 111.499 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -49.88 -29.05 7.44 Favored 'General case' 0 CA--C 1.562 1.41 0 N-CA-C 113.5 0.926 . . . . 70.22 113.5 -178.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -80.13 -44.75 19.38 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 112.717 0.636 . . . . 73.52 112.717 171.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.437 ' HG2' ' HA ' ' B' ' 44' ' ' ASP . 14.0 pt20 -69.91 -36.28 75.24 Favored 'General case' 0 N--CA 1.509 2.504 0 CA-C-N 119.09 0.859 . . . . 75.33 112.992 -175.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.468 HG23 HD22 ' B' ' 49' ' ' LEU . 34.2 m -79.89 -25.06 11.96 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.166 0.586 . . . . 70.14 111.635 -178.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.468 HD22 HG23 ' B' ' 48' ' ' VAL . 4.2 mm? -91.9 7.05 43.83 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.634 0.774 . . . . 70.42 111.824 173.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 45.9 t -60.08 -34.23 73.16 Favored 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 118.236 0.471 . . . . 73.21 110.957 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -108.7 111.53 60.99 Favored Pre-proline 0 CA--C 1.563 1.463 0 C-N-CA 123.928 0.891 . . . . 71.51 109.009 162.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -54.52 -32.65 74.87 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 123.232 2.621 . . . . 74.43 113.996 177.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -95.06 -176.79 3.93 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.403 0.681 . . . . 61.14 110.865 176.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.472 HD13 HH11 ' B' ' 57' ' ' ARG . 0.7 OUTLIER -97.25 69.78 2.3 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 121.568 0.699 . . . . 71.35 111.451 -179.666 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 54.5 t -92.07 -58.08 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 O-C-N 121.908 -0.495 . . . . 75.11 110.605 -178.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.404 ' HB ' ' HG2' ' B' ' 59' ' ' ARG . 2.9 pp -97.17 27.5 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 C-N-CA 123.741 0.816 . . . . 64.42 111.651 175.677 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.472 HH11 HD13 ' B' ' 54' ' ' LEU . 25.7 ttt85 -44.66 -34.82 2.34 Favored 'General case' 0 CA--C 1.565 1.536 0 N-CA-C 115.34 1.608 . . . . 63.2 115.34 -172.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.471 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 34.3 mmtp -64.14 -41.61 97.11 Favored 'General case' 0 CA--C 1.555 1.143 0 N-CA-C 112.408 0.521 . . . . 72.25 112.408 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.404 ' HG2' ' HB ' ' B' ' 56' ' ' ILE . 16.7 ptt180 -82.47 -26.35 32.71 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 122.11 -0.369 . . . . 50.24 110.721 173.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.518 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 20.1 ttmm -55.46 -54.72 40.28 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.001 0.921 . . . . 73.44 111.69 179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.654 HG22 ' HD3' ' B' ' 27' ' ' PRO . 16.2 t -76.67 -31.3 19.61 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 122.365 -0.21 . . . . 64.31 110.664 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -63.42 -37.45 94.83 Favored Glycine 0 CA--C 1.539 1.545 0 N-CA-C 114.199 0.44 . . . . 73.31 114.199 -178.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.24 -31.31 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.328 0 C-N-CA 123.076 0.55 . . . . 74.11 111.323 178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.453 HD21 HD11 ' B' ' 30' ' ' ILE . 36.3 tp -59.48 -53.56 56.75 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.531 0.732 . . . . 71.32 111.271 168.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.469 ' O ' ' HG3' ' B' ' 69' ' ' GLN . 80.4 mt -52.33 -44.49 65.17 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.84 0.856 . . . . 54.2 110.733 176.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -56.98 -46.74 82.0 Favored 'General case' 0 CA--C 1.561 1.393 0 C-N-CA 124.114 0.965 . . . . 72.41 112.422 175.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.552 HG23 HH21 ' B' ' 70' ' ' ARG . 53.6 mt -65.13 -36.91 78.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 123.291 0.636 . . . . 64.02 111.68 177.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' B' ' 64' ' ' LEU . 79.6 mt -69.35 -29.77 67.64 Favored 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 123.157 0.583 . . . . 60.31 110.959 177.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' B' ' 65' ' ' LEU . 73.1 mt-30 -68.33 -34.68 76.54 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.739 0.816 . . . . 73.42 111.592 172.06 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.552 HH21 HG23 ' B' ' 67' ' ' ILE . 62.2 mtm180 -64.59 -27.77 69.17 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 122.775 0.43 . . . . 74.51 112.03 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 67.8 p -85.49 -4.48 59.17 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.723 0.409 . . . . 74.33 111.322 175.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.23 -129.06 8.84 Favored Glycine 0 C--N 1.353 1.505 0 C-N-CA 123.233 0.444 . . . . 31.24 114.009 178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -73.83 -18.26 60.96 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.872 0.869 . . . . 73.1 111.116 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.465 ' HD2' ' HE1' ' B' ' 105' ' ' MET . 23.7 mmmt -54.54 -62.34 1.72 Allowed 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.342 1.057 . . . . 60.23 111.248 172.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.58 -30.68 75.11 Favored Glycine 0 C--N 1.343 0.931 0 CA-C-N 115.855 -0.611 . . . . 75.03 113.223 -179.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 50.5 t80 -54.76 -64.81 0.72 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.278 0.631 . . . . 73.04 112.451 171.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 89.2 t -62.19 -32.66 55.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 111.659 0.244 . . . . 54.22 111.659 178.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.8 -41.26 99.21 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 112.212 0.449 . . . . 73.2 112.212 175.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -70.74 -42.03 71.04 Favored 'General case' 0 N--CA 1.48 1.041 0 O-C-N 122.339 -0.226 . . . . 74.22 110.463 176.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.436 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 96.2 mt -57.38 -44.03 84.12 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.314 0.645 . . . . 64.53 111.558 174.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -67.03 -49.7 64.42 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.256 1.422 . . . . 75.12 112.044 -178.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 78.0 p -64.3 -43.98 93.05 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 115.789 -0.641 . . . . 61.32 110.115 177.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 32.1 tp -61.46 -41.39 97.16 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.513 0.725 . . . . 62.3 111.472 177.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.11 -35.36 73.3 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.572 0.749 . . . . 71.33 110.912 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.6 tt -72.82 -60.93 2.0 Allowed 'General case' 0 CA--C 1.563 1.455 0 C-N-CA 124.18 0.992 . . . . 71.22 111.046 176.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -76.26 -50.39 14.54 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 113.325 0.861 . . . . 73.25 113.325 -171.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -125.73 76.02 70.4 Favored Pre-proline 0 N--CA 1.491 1.585 0 C-N-CA 122.905 0.482 . . . . 64.1 111.141 178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -63.07 -19.67 69.5 Favored 'Trans proline' 0 C--N 1.384 2.414 0 C-N-CA 122.729 2.286 . . . . 74.21 113.534 -179.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -72.2 -46.31 56.74 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 123.479 0.712 . . . . 71.13 111.263 172.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.446 ' O ' HG13 ' B' ' 94' ' ' VAL . 4.5 mm? -61.3 -39.39 90.29 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.002 0.521 . . . . 52.22 109.84 174.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.436 ' HE1' ' HB3' ' B' ' 80' ' ' LEU . 79.5 t80 -63.54 -49.39 73.66 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.075 0.55 . . . . 74.4 111.38 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -52.98 -45.64 67.92 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.664 0.786 . . . . 72.55 111.565 177.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -76.1 -39.32 55.51 Favored 'General case' 0 CA--C 1.557 1.222 0 N-CA-C 112.93 0.715 . . . . 65.4 112.93 -178.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.516 HG23 HG23 ' B' ' 95' ' ' THR . 31.1 m -64.35 -39.99 87.5 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 CA-C-N 119.064 0.847 . . . . 54.4 113.055 177.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.516 HG23 HG23 ' B' ' 94' ' ' VAL . 81.9 p -93.77 -35.35 12.81 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 112.673 0.62 . . . . 55.34 112.673 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 101.31 -20.41 47.18 Favored Glycine 0 N--CA 1.476 1.335 0 CA-C-N 116.427 -0.351 . . . . 15.41 113.926 -176.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.64 165.11 13.97 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.558 0.694 . . . . 73.23 111.536 179.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -66.28 158.75 76.15 Favored Pre-proline 0 CA--C 1.556 1.204 0 CA-C-N 114.498 -1.228 . . . . 72.23 113.015 -174.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -54.88 104.32 0.12 Allowed 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.638 2.225 . . . . 64.31 111.68 162.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -105.33 -8.09 18.44 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.648 0.779 . . . . 42.12 110.98 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.469 ' HD2' ' HG2' ' A' ' 120' ' ' MET . 67.3 mtm180 77.31 54.39 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.285 1.434 . . . . 72.11 111.753 171.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.7 t -85.87 49.39 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.571 1.788 0 CA-C-O 122.093 0.949 . . . . 70.14 111.084 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.423 ' O ' HG12 ' B' ' 107' ' ' ILE . 74.7 m-85 -64.97 9.98 0.08 Allowed 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 115.423 1.638 . . . . 71.32 115.423 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 85.1 p -53.12 -22.88 6.9 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.442 1.097 . . . . 75.01 113.619 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . 0.465 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 31.3 tpp -62.14 -62.92 1.44 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.167 0.587 . . . . 74.23 111.108 175.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.56 HG21 HD13 ' B' ' 115' ' ' LEU . 0.1 OUTLIER -68.07 -30.13 47.02 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 123.523 0.729 . . . . 62.44 110.699 -179.723 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.423 HG12 ' O ' ' B' ' 103' ' ' PHE . 51.2 mm -66.97 -40.28 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 121.695 -0.628 . . . . 65.34 111.243 175.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.21 -38.44 78.59 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.022 0.529 . . . . 64.34 111.474 172.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.535 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -77.51 -53.52 7.51 Favored 'General case' 0 CA--C 1.56 1.363 0 N-CA-C 114.032 1.123 . . . . 65.31 114.032 -171.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 69.3 m -122.1 -2.75 9.11 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.227 0.825 . . . . 72.41 113.227 -178.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 91.29 173.01 43.36 Favored Glycine 0 N--CA 1.479 1.543 0 N-CA-C 114.234 0.454 . . . . 30.43 114.234 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -62.31 -40.3 95.84 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.415 0.686 . . . . 51.55 111.925 176.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 44.1 t -62.19 -34.15 75.9 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 122.855 0.462 . . . . 54.41 111.937 175.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -59.9 -52.38 53.26 Favored Glycine 0 CA--C 1.534 1.279 0 CA-C-O 121.283 0.38 . . . . 73.1 112.735 175.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.56 HD13 HG21 ' B' ' 106' ' ' ILE . 40.3 tp -67.04 -32.66 74.01 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.048 0.539 . . . . 74.52 111.909 176.214 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 99.3 m -58.59 -47.2 85.09 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.959 0.503 . . . . 73.05 109.685 173.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -67.35 -38.2 84.46 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.694 0.798 . . . . 72.04 112.307 178.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' B' ' 36' ' ' GLN . 72.8 mt -62.22 -51.11 69.09 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.137 0.575 . . . . 60.3 112.193 177.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.646 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.2 mt -68.24 -41.01 81.84 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.219 0.608 . . . . 74.35 111.35 178.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.416 ' O ' HG22 ' B' ' 123' ' ' VAL . 9.7 tpt -59.61 -43.59 93.72 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.92 0.888 . . . . 74.41 112.208 177.404 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . 0.433 ' O ' ' HG3' ' B' ' 125' ' ' LYS . 14.7 t -70.06 -39.19 75.81 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 121.971 -0.455 . . . . 70.51 110.658 172.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -61.03 -36.75 80.38 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.317 0.647 . . . . 73.43 112.214 -177.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.457 HG13 ' O ' ' B' ' 119' ' ' LEU . 10.6 m -67.15 -27.0 37.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 CA-C-N 117.969 0.349 . . . . 73.42 110.796 175.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 74.7 mtm -82.7 -33.59 27.55 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.258 0.623 . . . . 65.32 110.514 178.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' B' ' 121' ' ' THR . 28.0 mtpp -61.29 -46.95 88.19 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.895 0.878 . . . . 73.04 110.117 171.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.594 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 25.6 mt -68.92 -32.59 72.32 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 114.251 -1.34 . . . . 53.42 112.404 173.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -60.79 -44.92 96.18 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 122.92 0.488 . . . . 62.14 110.939 174.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.98 -39.27 63.8 Favored 'General case' 0 N--CA 1.484 1.27 0 CA-C-N 115.739 -0.664 . . . . 74.31 110.709 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.457 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 59.7 tptt -54.8 -47.73 73.66 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.353 1.061 . . . . 42.42 111.074 174.01 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.455 HG13 HD11 ' A' ' 133' ' ' LEU . 37.1 t -65.52 -45.61 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.766 0.827 . . . . 72.34 110.878 179.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.548 ' HA ' HG22 ' B' ' 134' ' ' THR . 2.8 pt20 -68.22 -30.27 69.29 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 111.768 0.284 . . . . 70.51 111.768 -177.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.457 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 72.6 m-20 -68.03 -44.99 75.21 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.33 0.252 . . . . 72.22 110.489 174.188 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 12.3 mt -70.4 -35.61 73.56 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 116.637 -0.256 . . . . 71.32 110.763 -176.376 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.548 HG22 ' HA ' ' B' ' 131' ' ' GLN . 5.8 t -74.64 -27.08 60.28 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 122.423 0.289 . . . . 62.33 110.968 176.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.59 -43.59 89.22 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 120.985 0.421 . . . . 74.32 110.653 170.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' B' ' 132' ' ' ASP . 41.8 mt -77.5 -20.65 53.99 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.433 0.693 . . . . 71.32 111.406 177.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -78.81 -36.18 43.04 Favored 'General case' 0 N--CA 1.483 1.187 0 CA-C-O 121.285 0.564 . . . . 72.41 109.946 175.344 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 36.6 t -70.27 -29.6 66.42 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 115.813 -0.631 . . . . 74.12 111.71 173.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 47.5 t -153.06 129.64 10.75 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 122.931 0.492 . . . . 70.11 112.085 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.467 ' HG3' ' NZ ' ' A' ' 140' ' ' LYS . 54.6 mtpt -113.48 179.92 3.82 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 123.34 0.656 . . . . 71.24 111.079 171.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 69.98 12.9 7.89 Favored 'General case' 0 CA--C 1.569 1.675 0 C-N-CA 124.117 0.967 . . . . 51.42 111.928 177.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 . . . . . 0 N--CA 1.492 1.642 0 C-N-CA 123.263 0.625 . . . . 72.2 112.119 -178.552 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.758 0 CA-C-O 119.652 -0.527 . . . . 74.14 113.51 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.7 m -89.92 76.45 7.09 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 117.724 0.762 . . . . 73.52 111.337 -178.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.66 123.3 23.78 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.334 0.654 . . . . 72.41 110.83 -179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 77.1 m-85 -87.25 -41.32 13.78 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.837 0.855 . . . . 63.31 111.87 -173.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.4 mm-40 -80.79 84.95 6.2 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 123.101 0.56 . . . . 54.42 110.678 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 35.0 m-80 -73.18 95.3 2.07 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.211 0.605 . . . . 72.04 110.839 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.498 ' HB3' ' N ' ' A' ' 73' ' ' HIS . 13.5 t70 -90.54 69.37 6.78 Favored 'General case' 0 CA--C 1.559 1.322 0 CA-C-O 122.343 1.068 . . . . 73.33 109.647 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -81.57 -16.32 52.01 Favored 'General case' 0 CA--C 1.554 1.104 0 CA-C-N 114.64 -1.164 . . . . 74.54 111.99 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -56.65 -44.28 81.15 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.478 0.711 . . . . 64.43 111.569 178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 99.5 m -62.46 -44.11 97.19 Favored 'General case' 0 CA--C 1.548 0.897 0 CA-C-N 115.887 -0.597 . . . . 71.05 111.362 174.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.427 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 45.9 m95 -52.58 -21.09 3.49 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 114.359 1.244 . . . . 75.1 114.359 178.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 m -52.37 -29.78 25.6 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 113.686 0.995 . . . . 63.21 113.686 -178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.42 -42.27 87.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 C-N-CA 124.109 0.964 . . . . 74.31 111.483 173.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 98.3 mt -85.53 -40.51 16.24 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.955 0.902 . . . . 72.25 112.836 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.427 ' HG2' ' O ' ' A' ' 11' ' ' TRP . 12.6 mm-40 -49.3 -54.24 18.0 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 124.033 0.933 . . . . 72.43 112.545 -177.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.84 -25.88 59.72 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-N 116.146 -0.479 . . . . 74.12 114.23 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.4 ' O ' ' HG ' ' A' ' 21' ' ' LEU . 95.8 m-85 -110.84 18.17 19.83 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.605 0.762 . . . . 71.22 111.717 178.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.448 ' HG3' HD12 ' A' ' 65' ' ' LEU . 35.7 ttm180 -56.56 -41.63 77.22 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 117.782 0.264 . . . . 61.45 110.887 178.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 13.3 p -61.36 -31.4 50.27 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.669 0 C-N-CA 123.682 0.793 . . . . 64.01 112.445 176.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.3 m -71.17 -49.66 41.49 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.202 0.601 . . . . 51.5 110.748 174.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 17' ' ' PHE . 47.3 mt -60.77 -36.83 79.94 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 114.993 -1.003 . . . . 63.34 111.319 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.523 HG22 ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -76.82 -23.67 52.77 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.257 0.623 . . . . 74.21 112.656 -179.169 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.2 t -80.37 -43.44 21.09 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.718 0.407 . . . . 71.13 111.169 176.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.739 HG11 HD21 ' A' ' 90' ' ' LEU . 43.0 t -92.26 -55.07 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 N-CA-C 113.698 0.999 . . . . 73.13 113.698 -172.22 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.565 HD13 HD11 ' A' ' 83' ' ' LEU . 80.4 mt -73.16 138.52 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 112.769 0.655 . . . . 73.41 112.769 -168.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -111.04 107.03 57.72 Favored Pre-proline 0 C--O 1.256 1.412 0 C-N-CA 123.166 0.586 . . . . 72.35 109.425 177.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.557 ' HD3' HG22 ' A' ' 61' ' ' VAL . 84.1 Cg_exo -50.12 -24.63 11.47 Favored 'Trans proline' 0 C--N 1.384 2.42 0 C-N-CA 123.848 3.032 . . . . 65.41 115.089 -177.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' HD11 ' A' ' 49' ' ' LEU . 93.6 p -65.82 -33.25 75.41 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-N 117.844 0.293 . . . . 62.52 110.973 -175.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -91.31 -10.2 42.23 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -176.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 27' ' ' PRO . 28.3 pt -107.31 -15.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 118.31 0.505 . . . . 72.12 111.689 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 40' ' ' LEU . 9.1 p -55.17 -45.58 99.82 Favored Pre-proline 0 N--CA 1.496 1.855 0 N-CA-C 114.089 1.144 . . . . 51.3 114.089 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -64.17 -31.58 64.2 Favored 'Trans proline' 0 C--N 1.398 3.14 0 CA-C-N 121.632 1.619 . . . . 64.4 112.509 179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -71.27 -46.17 61.51 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 123.071 0.548 . . . . 71.14 111.395 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 40' ' ' LEU . 86.0 mt -61.93 -24.92 67.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 123.507 0.723 . . . . 74.13 112.359 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -65.86 -49.75 67.01 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.539 0.736 . . . . 64.22 111.018 168.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 106' ' ' ILE . 14.4 mm100 -56.85 -35.34 68.75 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.784 0.834 . . . . 72.24 111.334 174.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.2 m -75.11 -14.31 60.56 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.978 0.911 . . . . 74.01 112.54 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt 72.48 14.23 5.31 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.618 1.167 . . . . 73.31 112.953 174.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 35.3 m -98.58 -30.01 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.514 0.726 . . . . 63.51 111.552 -177.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -80.53 115.72 20.19 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.329 0.651 . . . . 75.12 110.581 -179.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 21.5 m-80 -78.6 147.48 71.49 Favored Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 123.872 0.869 . . . . 72.34 110.394 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -46.11 -32.5 10.16 Favored 'Trans proline' 0 C--N 1.377 2.03 0 C-N-CA 123.634 2.889 . . . . 54.23 114.688 175.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -65.36 -35.68 81.71 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.564 0.746 . . . . 73.22 112.87 178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -58.04 -65.84 0.58 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.938 0.895 . . . . 74.43 110.807 -179.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -52.09 -24.73 7.29 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 113.439 0.903 . . . . 71.35 113.439 -179.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -76.42 -61.41 1.96 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 122.878 0.471 . . . . 70.5 111.941 173.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -77.15 -27.68 53.93 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 113.207 0.817 . . . . 74.1 113.207 -168.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.579 HG22 HG23 ' A' ' 63' ' ' VAL . 78.9 t -72.4 -31.0 36.76 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.435 0 C-N-CA 123.251 0.62 . . . . 74.12 110.742 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 28' ' ' SER . 3.9 mm? -102.01 17.09 24.07 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.126 0.97 . . . . 71.54 111.842 178.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -86.75 6.43 31.45 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 112.92 0.711 . . . . 53.0 112.92 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.518 ' HA ' HD11 ' A' ' 56' ' ' ILE . 1.9 m-20 -41.46 108.62 0.59 Allowed Pre-proline 0 N--CA 1.496 1.827 0 C-N-CA 126.082 1.753 . . . . 73.24 114.592 -173.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -60.42 -29.14 88.1 Favored 'Trans proline' 0 C--N 1.378 2.088 0 C-N-CA 122.558 2.172 . . . . 74.43 112.559 168.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.406 ' HB3' HG23 ' A' ' 55' ' ' VAL . 81.4 m-20 -155.7 156.13 34.38 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 125.385 1.474 . . . . 71.45 109.864 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -64.27 -9.3 16.59 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.216 0.821 . . . . 73.21 113.216 171.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.406 HG23 ' HB3' ' A' ' 53' ' ' ASN . 57.7 t -54.18 -40.35 46.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.079 0.952 . . . . 63.23 112.014 178.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.518 HD11 ' HA ' ' A' ' 51' ' ' ASP . 40.6 pt -88.27 15.26 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.12 0 N-CA-C 113.614 0.968 . . . . 71.23 113.614 -174.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -54.52 -23.48 16.62 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 123.852 0.861 . . . . 71.4 113.062 176.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -70.86 -44.22 66.86 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.826 0.85 . . . . 65.41 112.033 176.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -86.26 -18.15 32.82 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.828 -0.545 . . . . 74.31 111.937 176.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.506 ' HE3' ' HD2' ' A' ' 27' ' ' PRO . 56.2 tttp -52.56 -54.81 27.79 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.742 1.217 . . . . 55.22 112.658 179.435 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.557 HG22 ' HD3' ' A' ' 27' ' ' PRO . 5.3 t -77.86 -24.44 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 CA-C-O 120.643 0.258 . . . . 52.03 110.505 178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -68.38 -37.63 86.17 Favored Glycine 0 C--N 1.35 1.314 0 CA-C-N 116.401 -0.363 . . . . 34.04 113.462 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.579 HG23 HG22 ' A' ' 48' ' ' VAL . 35.1 m -74.38 -35.56 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 122.853 0.461 . . . . 73.12 110.093 177.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -52.44 -54.95 25.5 Favored 'General case' 0 CA--C 1.562 1.426 0 C-N-CA 124.263 1.025 . . . . 75.04 110.612 169.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 71.6 mt -58.31 -38.92 78.05 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.515 0.726 . . . . 74.53 112.244 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -62.59 -42.5 99.6 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.148 0.979 . . . . 72.51 111.437 179.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 63' ' ' VAL . 73.7 mt -71.21 -43.89 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.23 0 C-N-CA 123.409 0.684 . . . . 74.32 110.842 179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.6 mt -65.21 -32.3 73.91 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 112.289 0.477 . . . . 74.43 112.289 176.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -67.83 -21.88 65.18 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 112.373 0.508 . . . . 74.21 112.373 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.499 0.72 . . . . 71.25 112.071 174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.5 p -92.56 6.31 47.69 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 123.018 0.527 . . . . 34.32 111.367 176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.04 -123.33 29.84 Favored Glycine 0 C--N 1.356 1.689 0 C-N-CA 123.776 0.703 . . . . 74.52 114.786 177.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.498 ' N ' ' HB3' ' A' ' 7' ' ' ASP . 22.6 t60 -60.28 -35.51 75.72 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 124.915 1.286 . . . . 75.22 110.913 -176.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt -63.18 -49.02 75.93 Favored 'General case' 0 CA--C 1.547 0.845 0 CA-C-N 114.648 -1.16 . . . . 73.31 111.959 -175.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.33 97.35 Favored Glycine 0 N--CA 1.478 1.446 0 O-C-N 123.346 0.404 . . . . 61.24 113.436 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.495 ' CZ ' HD11 ' A' ' 80' ' ' LEU . 69.5 t80 -53.3 -62.46 1.64 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.125 0.97 . . . . 63.03 111.742 171.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 79.3 t -54.46 -45.34 70.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.205 0 C-N-CA 124.424 1.089 . . . . 52.11 111.624 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.93 -40.67 95.4 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.348 1.059 . . . . 75.13 113.083 -179.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -67.08 -45.21 77.96 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.765 0.317 . . . . 72.43 110.488 177.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.495 HD11 ' CZ ' ' A' ' 76' ' ' TYR . 96.2 mt -59.7 -37.64 79.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.082 0.553 . . . . 61.01 112.016 175.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.34 -38.6 85.11 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 124.593 1.157 . . . . 72.11 111.309 177.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 70.7 m -62.74 -38.11 89.23 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.196 0.598 . . . . 71.42 110.765 171.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.565 HD11 HD13 ' A' ' 25' ' ' ILE . 7.6 mp -69.78 -38.22 76.62 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.922 0.489 . . . . 75.23 111.72 174.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.57 -27.97 63.16 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.528 0.731 . . . . 74.2 111.396 179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.6 tt -96.95 -52.34 3.91 Favored 'General case' 0 CA--C 1.568 1.662 0 C-N-CA 123.891 0.876 . . . . 73.32 111.249 176.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -88.72 -55.98 3.49 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 113.896 1.073 . . . . 74.13 113.896 -172.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.405 ' HB2' ' HG ' ' A' ' 83' ' ' LEU . 95.7 m-85 -116.48 79.77 9.59 Favored Pre-proline 0 N--CA 1.504 2.258 0 CA-C-N 118.818 0.735 . . . . 71.13 111.533 -177.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.456 ' O ' ' HG2' ' A' ' 92' ' ' LYS . 35.7 Cg_endo -61.6 -50.57 5.29 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.568 2.179 . . . . 73.31 113.073 -171.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.416 ' HG3' HD22 ' A' ' 90' ' ' LEU . 29.4 pt20 -64.24 -32.0 73.42 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.709 0.404 . . . . 71.11 111.891 -176.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.739 HD21 HG11 ' A' ' 24' ' ' VAL . 4.3 mm? -60.95 -42.37 98.11 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.347 0.659 . . . . 71.42 111.858 174.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.52 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 1.5 t80 -65.58 -52.05 55.17 Favored 'General case' 0 CA--C 1.558 1.285 0 CA-C-O 121.529 0.68 . . . . 73.1 110.327 174.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.456 ' HG2' ' O ' ' A' ' 88' ' ' PRO . 24.3 mmtp -71.42 -19.0 62.3 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.967 0.729 . . . . 71.32 112.967 -173.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 19.8 ptmt -84.6 -40.02 18.0 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 118.304 0.502 . . . . 75.32 111.42 175.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 26.5 m -68.31 -35.85 72.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 CA-C-N 118.409 0.55 . . . . 74.02 111.137 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 81.2 p -86.91 -45.49 10.78 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 112.431 0.53 . . . . 62.14 112.431 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 80.7 3.16 90.31 Favored Glycine 0 N--CA 1.481 1.699 0 N-CA-C 115.929 1.132 . . . . 42.33 115.929 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.61 170.37 15.85 Favored 'General case' 0 N--CA 1.496 1.857 0 CA-C-N 118.073 0.936 . . . . 71.11 112.228 179.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -70.27 119.51 72.56 Favored Pre-proline 0 CA--C 1.554 1.104 0 CA-C-N 115.665 -0.698 . . . . 74.21 110.061 172.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -83.39 -171.61 1.15 Allowed 'Trans proline' 0 C--N 1.366 1.462 0 C-N-CA 122.919 2.413 . . . . 62.32 113.095 -176.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.1 3.6 10.19 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.826 0.85 . . . . 62.45 113.168 177.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 82.1 mtm180 63.64 48.69 3.25 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.263 1.025 . . . . 71.13 108.901 -178.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.412 ' H ' HG23 ' A' ' 102' ' ' VAL . 43.8 t -29.15 -18.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 121.139 3.755 . . . . 74.43 121.139 -164.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' A' ' 107' ' ' ILE . 91.7 m-85 -45.29 -17.03 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 N-CA-C 116.578 2.066 . . . . 74.41 116.578 -173.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 78.3 p -60.55 -23.91 64.99 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 123.81 0.844 . . . . 62.55 113.132 174.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 12.5 tpt -67.29 -54.15 23.41 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.263 1.025 . . . . 63.44 110.994 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD11 ' HB3' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -68.75 -29.49 43.8 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 123.321 0.648 . . . . 63.32 110.642 177.664 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.1 mm -61.8 -40.05 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 122.072 -0.392 . . . . 74.15 110.812 169.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -74.17 -31.09 62.56 Favored 'General case' 0 CA--C 1.57 1.722 0 C-N-CA 123.04 0.536 . . . . 70.11 112.26 173.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 106' ' ' ILE . . . -82.57 -63.1 1.44 Allowed 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.616 0.766 . . . . 75.42 112.674 -173.326 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.0 t -104.46 -0.99 27.32 Favored 'General case' 0 N--CA 1.5 2.049 0 C-N-CA 123.691 0.796 . . . . 33.21 111.867 -178.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.01 171.32 47.53 Favored Glycine 0 N--CA 1.475 1.241 0 N-CA-C 113.466 0.147 . . . . 70.43 113.466 -178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.14 -36.2 82.5 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.79 0.436 . . . . 75.44 110.979 174.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 99.6 p -58.35 -43.6 88.42 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.573 0.749 . . . . 73.22 110.699 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.19 -54.96 32.97 Favored Glycine 0 C--N 1.357 1.702 0 O-C-N 123.46 0.475 . . . . 62.22 113.528 177.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 28.9 tp -67.0 -33.85 76.46 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 111.835 0.309 . . . . 73.44 111.835 179.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 23.4 m -61.41 -47.11 87.26 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 122.983 0.513 . . . . 73.24 111.275 175.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -66.54 -40.59 89.16 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.82 0.448 . . . . 74.11 111.527 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.0 -53.01 63.22 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.231 0.612 . . . . 61.11 110.089 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 66.8 mt -63.7 -40.86 97.83 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.008 0.923 . . . . 61.44 112.139 -177.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.513 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -71.14 -40.41 71.38 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.419 0.288 . . . . 72.11 110.545 -176.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -68.59 -34.7 76.24 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 120.476 -0.49 . . . . 70.43 110.186 173.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.6 tp10 -64.84 -28.55 69.63 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.599 0.76 . . . . 72.15 111.893 179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.513 HG22 ' O ' ' A' ' 120' ' ' MET . 2.6 m -63.46 -32.42 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 CA-C-N 118.114 0.415 . . . . 74.53 110.374 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 43.3 mtm -79.8 -41.98 25.36 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.063 0.545 . . . . 64.33 109.694 -176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.9 mtpm? -54.63 -44.46 73.2 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.118 0.967 . . . . 73.22 111.352 172.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 12.7 mt -73.21 -34.54 65.99 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.131 -0.941 . . . . 73.25 111.867 179.061 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 78.5 mt-30 -65.23 -29.69 70.5 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.411 0.55 . . . . 73.23 111.585 170.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -74.01 -38.8 63.98 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.732 0.413 . . . . 44.41 110.244 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.495 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.4 tptt -61.26 -44.89 96.5 Favored 'General case' 0 CA--C 1.559 1.303 0 C-N-CA 123.282 0.633 . . . . 73.31 111.086 171.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -62.35 -47.17 94.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 123.587 0.755 . . . . 62.11 110.878 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.587 ' HA ' HG22 ' A' ' 134' ' ' THR . 2.8 pt20 -69.58 -29.89 67.54 Favored 'General case' 0 N--CA 1.484 1.265 0 O-C-N 122.272 -0.268 . . . . 73.41 111.552 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.504 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 31.0 t70 -62.38 -41.79 98.91 Favored 'General case' 0 C--N 1.358 0.96 0 C-N-CA 122.923 0.489 . . . . 54.32 110.067 174.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 18.6 mt -75.63 -44.65 41.67 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 115.982 -0.554 . . . . 75.35 111.234 -175.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.587 HG22 ' HA ' ' A' ' 131' ' ' GLN . 9.9 t -67.76 -29.85 69.16 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.394 0.278 . . . . 74.54 111.401 178.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -62.96 -50.42 70.85 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.156 0.582 . . . . 42.54 110.523 174.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.586 ' HB2' HD11 ' B' ' 137' ' ' LEU . 42.2 mt -74.81 -26.38 59.69 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.549 -0.751 . . . . 63.34 111.691 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.512 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.5 tt -70.12 -50.43 40.72 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 123.747 0.819 . . . . 45.45 109.071 179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 30.7 t -65.46 -19.4 65.92 Favored 'General case' 0 N--CA 1.481 1.11 0 CA-C-N 115.113 -0.949 . . . . 61.13 112.473 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.9 t -128.78 67.64 1.4 Allowed 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.225 0.61 . . . . 74.34 111.317 179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.553 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.5 mtpm? -99.77 172.68 7.11 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.346 0.659 . . . . 71.41 112.243 173.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -85.08 -58.09 2.83 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 115.333 -0.848 . . . . 62.43 111.03 -179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 . . . . . 0 CA--C 1.575 1.925 0 C-N-CA 125.447 1.499 . . . . 73.44 114.289 -174.012 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.386 0 CA-C-O 120.012 -0.326 . . . . 64.41 113.054 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -142.89 17.1 1.96 Allowed 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.348 0.659 . . . . 74.14 112.226 -179.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -70.8 169.96 13.51 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.983 0.513 . . . . 72.11 112.122 -175.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -55.14 -52.12 64.3 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.585 0.754 . . . . 75.11 112.253 -176.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 47.0 mm-40 -88.99 -29.04 19.8 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.471 0.708 . . . . 72.3 112.113 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -58.95 102.04 0.11 Allowed 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.28 0.562 . . . . 64.42 110.768 -175.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -94.43 64.96 3.18 Favored 'General case' 0 CA--C 1.548 0.867 0 CA-C-O 122.388 1.09 . . . . 63.54 109.766 -172.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -62.35 -36.26 81.66 Favored 'General case' 0 CA--C 1.551 0.991 0 CA-C-N 113.979 -1.464 . . . . 72.04 112.309 -176.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.91 -49.36 75.09 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 123.438 0.695 . . . . 73.53 112.804 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.7 m -64.63 -44.92 88.97 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 122.306 -0.246 . . . . 72.12 111.056 176.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 56.6 m95 -53.4 -36.95 62.02 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 113.772 1.027 . . . . 73.23 113.772 171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 58.4 m -67.16 -25.5 66.18 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 122.88 0.472 . . . . 63.52 111.816 -179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 46.5 t -68.56 -39.84 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.258 0.623 . . . . 75.23 110.633 174.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.92 -47.0 76.21 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.177 0.591 . . . . 75.22 110.641 172.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -70.41 -15.32 62.83 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-N 115.103 -0.953 . . . . 75.44 113.038 -176.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.28 -30.54 48.49 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-N 118.139 0.427 . . . . 65.25 112.921 163.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -105.87 22.07 16.22 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.621 1.169 . . . . 74.53 111.608 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -50.5 -49.78 54.62 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.203 1.001 . . . . 61.41 112.711 -176.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.4 p -54.77 -29.47 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 C-N-CA 123.763 0.825 . . . . 75.42 112.693 -178.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.536 HG21 ' NZ ' ' B' ' 93' ' ' LYS . 58.3 m -89.55 -43.15 11.0 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.21 0.604 . . . . 50.45 111.581 177.153 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.512 HD23 HD12 ' B' ' 90' ' ' LEU . 64.0 mt -55.71 -42.54 75.39 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-O 121.711 0.767 . . . . 75.42 111.082 177.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.504 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 82.2 p -75.19 -28.27 59.95 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.903 0.881 . . . . 74.33 112.676 -178.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 44.8 t -82.94 -31.69 27.56 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.75 0.82 . . . . 62.53 112.463 179.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.656 HG11 HD21 ' B' ' 90' ' ' LEU . 89.6 t -97.21 -53.97 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 C-N-CA 123.469 0.707 . . . . 51.11 112.07 -176.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 50.3 mt -74.17 142.16 15.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 CA-C-O 121.235 0.541 . . . . 71.23 112.026 -170.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.508 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 20.9 t70 -112.01 112.69 52.66 Favored Pre-proline 0 CA--C 1.55 0.976 0 C-N-CA 123.94 0.896 . . . . 71.51 109.03 176.079 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.729 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 64.0 Cg_exo -45.52 -44.24 17.16 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 123.502 2.801 . . . . 75.24 114.447 -177.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 61.7 p -75.14 -10.94 59.93 Favored 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.219 0.822 . . . . 60.45 113.219 -171.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.508 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 11.8 ptm180 -85.42 -33.45 21.93 Favored 'General case' 0 N--CA 1.495 1.775 0 CA-C-N 119.208 0.913 . . . . 72.33 110.469 174.576 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 26.3 pt -89.4 -20.14 7.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 C-N-CA 122.934 0.494 . . . . 71.22 111.45 177.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.439 ' HA ' HD13 ' B' ' 40' ' ' LEU . 10.6 m -50.93 -51.35 67.94 Favored Pre-proline 0 N--CA 1.5 2.063 0 C-N-CA 125.193 1.397 . . . . 74.42 114.247 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -60.12 -37.9 80.78 Favored 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 121.775 1.65 . . . . 72.33 113.053 -178.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -67.38 -45.1 77.25 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 122.943 0.497 . . . . 74.21 111.504 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 96.9 mt -60.2 -31.09 69.82 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 123.481 0.712 . . . . 71.5 112.544 177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -62.49 -49.49 75.16 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.626 0.77 . . . . 61.54 111.417 171.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -65.16 -32.64 74.43 Favored 'General case' 0 N--CA 1.482 1.142 0 CA-C-N 115.738 -0.664 . . . . 70.3 111.427 178.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 44.2 m -72.54 -11.07 60.51 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.891 0.876 . . . . 60.21 111.612 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt 74.72 12.23 3.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 125.262 1.425 . . . . 61.23 112.269 172.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 20.8 m -94.55 -40.6 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.322 0.649 . . . . 74.21 112.178 -176.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' B' ' 31' ' ' THR . 8.8 tt -81.31 117.06 21.48 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 122.687 0.395 . . . . 71.24 110.236 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.427 ' HB2' ' HB2' ' B' ' 44' ' ' ASP . 8.7 m-80 -65.09 152.77 90.67 Favored Pre-proline 0 CA--C 1.561 1.375 0 C-N-CA 123.86 0.864 . . . . 70.21 111.744 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' B' ' 46' ' ' GLU . 37.4 Cg_endo -63.6 -26.51 69.32 Favored 'Trans proline' 0 C--N 1.375 1.924 0 C-N-CA 121.625 1.55 . . . . 51.55 112.043 174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -78.36 -32.71 49.15 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.576 1.15 . . . . 75.15 111.112 177.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' B' ' 41' ' ' ASN . 64.0 t0 -55.2 -65.93 0.5 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 125.453 1.501 . . . . 54.02 110.477 -176.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.439 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.0 pt-20 -50.89 -32.51 20.76 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 114.367 1.247 . . . . 70.22 114.367 174.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' B' ' 42' ' ' PRO . 25.1 mm-40 -68.69 -48.6 63.47 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.092 0.406 . . . . 73.52 111.151 178.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -76.5 -28.5 56.44 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 112.323 0.49 . . . . 75.33 112.323 -178.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 54.8 t -73.47 -34.1 41.7 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.696 0.799 . . . . 70.14 111.331 175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -105.08 24.1 12.54 Favored 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 123.208 0.603 . . . . 70.42 111.796 175.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 79.0 p -63.79 -37.41 87.27 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.309 0.644 . . . . 73.21 112.448 179.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -87.67 152.55 51.85 Favored Pre-proline 0 CA--C 1.562 1.435 0 C-N-CA 123.883 0.873 . . . . 71.51 111.179 173.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -96.24 37.65 0.13 Allowed 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 123.449 2.766 . . . . 74.43 114.39 175.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.476 ' HB3' HG23 ' B' ' 55' ' ' VAL . 93.5 m-20 -140.24 144.09 36.32 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 113.217 0.821 . . . . 61.14 113.217 -167.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.586 ' H ' HD23 ' B' ' 54' ' ' LEU . 1.7 pt? -91.32 4.8 51.46 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 115.634 -0.712 . . . . 71.35 111.933 168.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . 0.476 HG23 ' HB3' ' B' ' 53' ' ' ASN . 49.9 t -56.51 -43.15 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 123.673 0.789 . . . . 75.11 111.31 176.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.427 HG22 HH11 ' B' ' 59' ' ' ARG . 2.8 pp -107.23 22.54 3.69 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.315 0 C-N-CA 124.458 1.103 . . . . 64.42 111.927 -176.412 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.534 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 20.4 ttt180 -58.3 -24.25 58.97 Favored 'General case' 0 N--CA 1.495 1.818 0 C-N-CA 124.248 1.019 . . . . 63.2 112.83 -172.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.504 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 99.2 mttt -70.71 -50.81 32.31 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.453 0.701 . . . . 72.25 112.335 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.427 HH11 HG22 ' B' ' 56' ' ' ILE . 10.0 ptp85 -70.97 -19.21 62.57 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 122.092 -0.38 . . . . 50.24 111.528 174.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.729 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 23.8 ttmm -66.19 -42.56 88.68 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 124.017 0.927 . . . . 73.44 111.604 173.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.5 HG22 ' HD3' ' B' ' 27' ' ' PRO . 39.5 t -73.75 -37.84 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 N-CA-C 109.827 -0.435 . . . . 64.31 109.827 171.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.09 -40.89 97.71 Favored Glycine 0 C--N 1.351 1.397 0 CA-C-N 115.865 -0.607 . . . . 73.31 114.325 -177.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.408 ' O ' HG13 ' B' ' 67' ' ' ILE . 28.6 m -70.02 -40.49 78.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 C-N-CA 122.393 0.277 . . . . 74.11 110.831 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 56.5 tp -56.56 -45.08 81.46 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.997 0.919 . . . . 71.32 111.956 179.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 83.1 mt -51.78 -52.47 48.66 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 123.834 0.854 . . . . 54.2 111.293 177.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -58.05 -41.9 84.28 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.806 1.242 . . . . 72.41 112.339 178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.408 HG13 ' O ' ' B' ' 63' ' ' VAL . 45.0 mt -73.4 -34.0 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 C-N-CA 122.993 0.517 . . . . 64.02 111.666 -177.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 89.0 mt -77.34 -24.37 50.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.809 0.444 . . . . 60.31 111.112 175.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -68.64 -24.6 64.56 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.146 0.578 . . . . 73.42 111.183 172.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 46.4 mtp180 -64.51 -29.81 70.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.636 0.774 . . . . 74.51 111.416 175.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 27.4 p -84.86 -2.36 57.68 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 123.202 0.601 . . . . 74.33 111.842 178.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 83.63 -143.16 21.45 Favored Glycine 0 C--N 1.349 1.252 0 N-CA-C 114.09 0.396 . . . . 31.24 114.09 176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.462 ' O ' HG23 ' B' ' 77' ' ' VAL . 18.7 t60 -70.1 -22.06 63.06 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.757 0.823 . . . . 73.1 110.457 -178.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 49.6 mtmt -58.2 -50.46 73.46 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.157 0.583 . . . . 60.23 111.635 174.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.5 -39.91 95.57 Favored Glycine 0 C--N 1.353 1.499 0 CA-C-N 116.496 -0.32 . . . . 75.03 112.895 177.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.436 ' CZ ' HD11 ' B' ' 80' ' ' LEU . 67.2 t80 -58.18 -52.59 64.93 Favored 'General case' 0 CA--C 1.559 1.317 0 C-N-CA 124.231 1.012 . . . . 73.04 112.294 174.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.462 HG23 ' O ' ' B' ' 73' ' ' HIS . 96.7 t -56.94 -47.65 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 C-N-CA 123.558 0.743 . . . . 54.22 110.919 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -62.65 -39.55 94.22 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.921 0.888 . . . . 73.2 112.294 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -63.83 -47.69 79.79 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 122.733 0.413 . . . . 74.22 110.174 177.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.513 ' HB3' ' HE1' ' B' ' 91' ' ' TYR . 85.2 mt -57.78 -49.78 75.47 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.183 0.593 . . . . 64.53 111.857 176.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -58.92 -46.48 87.85 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 125.799 1.639 . . . . 75.12 112.39 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 84.4 p -70.12 -40.27 74.95 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.993 -0.549 . . . . 61.32 110.806 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 30.7 tp -62.49 -48.09 81.12 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.32 0.648 . . . . 62.3 111.939 -177.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' B' ' 80' ' ' LEU . 10.0 pt-20 -66.6 -22.05 66.13 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 112.145 0.424 . . . . 71.33 112.145 -178.614 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 8.0 tt -75.21 -53.36 8.93 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 109.593 -0.521 . . . . 71.22 109.593 172.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -80.0 -66.43 0.88 Allowed 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.852 0.686 . . . . 73.25 112.852 -177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.499 ' HB3' HD23 ' B' ' 90' ' ' LEU . 70.8 m-85 -104.1 95.32 7.82 Favored Pre-proline 0 CA--C 1.562 1.441 0 C-N-CA 123.727 0.811 . . . . 64.1 112.177 -176.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -73.04 -34.35 6.47 Favored 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 122.695 2.263 . . . . 74.21 114.023 -174.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.403 ' HG3' HD22 ' B' ' 90' ' ' LEU . 29.4 pt20 -75.83 -38.49 58.0 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 122.727 0.411 . . . . 71.13 111.299 -179.517 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.656 HD21 HG11 ' B' ' 24' ' ' VAL . 4.2 mm? -55.08 -48.23 73.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 123.4 0.68 . . . . 52.22 109.804 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.524 ' CE2' ' HA ' ' B' ' 99' ' ' PRO . 52.1 t80 -63.15 -50.31 70.89 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 115.169 -0.923 . . . . 74.4 111.598 176.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -47.12 -45.05 21.99 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.426 1.091 . . . . 72.55 112.877 177.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.536 ' NZ ' HG21 ' B' ' 20' ' ' THR . 57.3 pttt -83.24 -39.53 20.78 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.506 0.928 . . . . 65.4 113.506 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.461 HG22 ' HA ' ' B' ' 91' ' ' TYR . 23.3 m -62.29 -35.98 72.16 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 CA-C-N 119.483 1.038 . . . . 54.4 112.066 178.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.438 HG23 HG23 ' B' ' 94' ' ' VAL . 52.7 p -94.03 -37.94 11.39 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.371 0.668 . . . . 55.34 111.995 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 106.56 -15.2 42.05 Favored Glycine 0 CA--C 1.539 1.556 0 CA-C-N 116.053 -0.521 . . . . 15.41 113.144 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -139.44 -177.19 4.82 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.276 0.63 . . . . 73.23 111.898 -175.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -66.55 158.54 78.38 Favored Pre-proline 0 CA--C 1.567 1.601 0 C-N-CA 124.435 1.094 . . . . 72.23 113.021 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.524 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 19.5 Cg_exo -40.98 113.25 0.23 Allowed 'Trans proline' 0 C--N 1.384 2.404 0 C-N-CA 124.043 3.162 . . . . 64.31 115.148 169.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.2 -39.22 89.48 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.563 0.745 . . . . 42.12 111.766 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 49.2 mtp180 81.66 47.14 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 113.437 -1.71 . . . . 72.11 110.464 174.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 5.8 t -77.83 45.97 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.567 1.616 0 C-N-CA 124.08 0.952 . . . . 70.14 111.658 175.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.428 ' O ' HG12 ' B' ' 107' ' ' ILE . 79.1 m-85 -62.93 -9.77 11.07 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.013 0.925 . . . . 71.32 112.742 174.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' B' ' 107' ' ' ILE . 70.3 p -61.22 -18.35 57.86 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 124.033 0.933 . . . . 75.01 112.157 174.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 8.9 tpt -65.4 -60.53 2.86 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.272 1.029 . . . . 74.23 111.607 174.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.42 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.8 -28.14 38.65 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.42 0 C-N-CA 123.665 0.786 . . . . 62.44 110.506 178.59 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.429 ' HB ' ' HA ' ' B' ' 104' ' ' SER . 39.1 mm -64.46 -41.42 92.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.103 0.561 . . . . 65.34 110.969 170.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -72.97 -36.05 67.02 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.083 0.553 . . . . 64.34 112.078 176.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . . . . . . . . . . . -81.95 -55.49 4.56 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.699 0.8 . . . . 65.31 112.497 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.6 t -100.92 -12.58 18.84 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 123.934 0.894 . . . . 72.41 112.615 -176.38 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 92.3 165.82 39.01 Favored Glycine 0 N--CA 1.475 1.271 0 CA-C-O 120.388 -0.118 . . . . 30.43 112.926 -174.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -64.16 -37.22 86.68 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.644 0.378 . . . . 51.55 111.239 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.6 p -61.39 -38.52 87.33 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.79 0.836 . . . . 54.41 111.555 175.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -57.56 -57.48 19.58 Favored Glycine 0 C--N 1.352 1.436 0 O-C-N 123.64 0.587 . . . . 73.1 112.624 176.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.42 HD13 HG21 ' B' ' 106' ' ' ILE . 27.7 tp -66.54 -31.22 71.79 Favored 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 111.874 0.324 . . . . 74.52 111.874 178.232 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 57.0 m -60.67 -48.29 82.44 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-N 118.08 0.4 . . . . 73.05 110.493 175.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 24.8 mm-40 -70.33 -34.85 73.16 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 112.255 0.465 . . . . 72.04 112.255 179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.83 -44.82 84.44 Favored 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 123.057 0.543 . . . . 60.3 112.349 176.101 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 94.4 mt -71.41 -36.64 71.41 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 123.034 0.534 . . . . 74.35 110.925 176.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 8.3 tpt -60.12 -45.15 93.97 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 123.488 0.715 . . . . 74.41 111.445 177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -71.38 -37.75 71.56 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 119.558 -0.258 . . . . 70.51 111.105 174.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.495 ' HA ' ' HD3' ' B' ' 125' ' ' LYS . 18.1 tp10 -59.3 -41.15 88.34 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.53 0.732 . . . . 73.43 112.138 -179.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.489 HG13 ' O ' ' B' ' 119' ' ' LEU . 11.7 m -67.0 -27.22 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 CA-C-O 119.481 -0.295 . . . . 73.42 110.793 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 63.9 mtm -81.3 -34.79 31.72 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-N 118.018 0.372 . . . . 65.32 110.475 -178.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.495 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 38.7 mtpt -53.63 -43.54 68.82 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 124.304 1.041 . . . . 73.04 110.896 166.513 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.548 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 20.6 mt -70.41 -42.45 71.64 Favored 'General case' 0 C--O 1.208 -1.099 0 CA-C-N 114.444 -1.253 . . . . 53.42 111.75 179.214 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 74.8 mt-30 -62.87 -32.48 73.73 Favored 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 123.06 0.544 . . . . 62.14 111.356 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' B' ' 131' ' ' GLN . 13.7 mptt -72.33 -39.49 68.14 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.409 0.683 . . . . 74.31 110.839 172.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.535 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 50.4 tptt -68.94 -29.82 68.14 Favored 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 122.974 0.51 . . . . 42.42 111.215 175.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.495 HG23 ' O ' ' B' ' 126' ' ' LEU . 34.9 t -69.33 -49.57 59.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 123.618 0.767 . . . . 72.34 109.506 175.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.729 ' HA ' HG22 ' B' ' 134' ' ' THR . 1.4 pt20 -68.78 -27.12 65.6 Favored 'General case' 0 CA--C 1.556 1.181 0 CA-C-N 116.534 -0.303 . . . . 70.51 111.33 -179.495 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -62.01 -37.63 85.59 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.72 1.208 . . . . 72.22 111.417 173.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 22.7 mt -86.41 -44.37 12.08 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.828 -0.624 . . . . 71.32 111.523 -177.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.729 HG22 ' HA ' ' B' ' 131' ' ' GLN . 12.1 t -67.75 -26.6 66.21 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 111.849 0.314 . . . . 62.33 111.849 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -54.95 -41.45 71.1 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.947 0.499 . . . . 74.32 112.139 170.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.512 ' HB2' HD11 ' A' ' 137' ' ' LEU . 21.1 mt -87.42 -37.34 17.11 Favored 'General case' 0 N--CA 1.482 1.166 0 CA-C-N 116.031 -0.532 . . . . 71.32 110.638 -177.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.586 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -60.24 -30.64 69.55 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 123.907 0.883 . . . . 72.41 110.359 173.158 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -74.23 -47.31 36.14 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.146 0.578 . . . . 74.12 110.517 172.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.8 t -151.22 116.68 5.38 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.976 0.511 . . . . 70.11 111.25 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.553 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 9.6 mtpm? -92.59 178.08 5.92 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.56 0.744 . . . . 71.24 110.896 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -126.4 62.27 1.28 Allowed 'General case' 0 CA--C 1.55 0.959 0 CA-C-O 121.832 0.825 . . . . 51.42 109.459 175.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 . . . . . 0 CA--C 1.567 1.601 0 CA-C-N 115.128 -0.942 . . . . 72.2 111.407 172.018 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.96 0 CA-C-O 120.361 -0.133 . . . . 74.14 113.322 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.7 p -158.04 -73.04 0.09 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.191 0.596 . . . . 73.52 109.97 179.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 67.87 -1.61 1.66 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 116.118 1.896 . . . . 72.41 116.118 165.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 58.7 m-85 -91.25 -46.04 8.28 Favored 'General case' 0 N--CA 1.488 1.433 0 CA-C-N 118.195 0.452 . . . . 63.31 110.868 175.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -82.33 72.11 9.39 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-O 121.748 0.785 . . . . 54.42 110.449 178.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 23.0 m120 -74.55 -59.0 2.93 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.855 -1.066 . . . . 72.04 112.09 -175.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -147.68 17.05 1.14 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 112.972 0.731 . . . . 73.33 112.972 -170.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.462 ' HB3' ' NE2' ' A' ' 69' ' ' GLN . 4.8 p-10 -57.92 -19.77 32.39 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 112.885 0.698 . . . . 74.54 112.885 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -59.51 -44.97 92.99 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.671 0.788 . . . . 64.43 111.733 174.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 64.1 m -66.18 -49.32 67.75 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 122.776 0.43 . . . . 71.05 110.279 176.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 93.8 m95 -53.76 -19.78 4.7 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 114.407 1.262 . . . . 75.1 114.407 174.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 48.1 t -61.99 -32.89 73.4 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.27 0.628 . . . . 63.21 112.283 176.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -66.27 -40.18 86.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 123.518 0.727 . . . . 74.31 110.991 177.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.0 mt -72.77 -34.8 67.2 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 116.157 -0.474 . . . . 72.25 111.118 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -58.09 -46.2 85.9 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 124.317 1.047 . . . . 72.43 113.076 -170.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -65.27 -3.65 13.44 Favored Glycine 0 CA--C 1.538 1.506 0 N-CA-C 114.616 0.606 . . . . 74.12 114.616 177.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.594 ' HB2' HG12 ' A' ' 94' ' ' VAL . 54.8 m-85 -129.45 2.36 5.07 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 124.018 0.927 . . . . 71.22 111.019 174.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 29.0 ptt180 -67.12 -25.16 66.05 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 111.892 0.33 . . . . 61.45 111.892 -171.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -59.19 -36.61 64.01 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.32 0 C-N-CA 122.977 0.511 . . . . 64.01 111.635 174.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.476 HG21 ' HE3' ' A' ' 93' ' ' LYS . 18.8 m -83.75 -40.88 18.26 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.291 0.636 . . . . 51.5 110.738 176.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.454 HD11 HG11 ' A' ' 94' ' ' VAL . 96.6 mt -52.72 -48.98 66.28 Favored 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 123.102 0.561 . . . . 63.34 111.144 176.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 61' ' ' VAL . 71.7 p -65.26 -40.59 94.14 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 115.468 -0.787 . . . . 74.21 112.073 -179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.4 t -75.89 -26.57 57.16 Favored 'General case' 0 CA--C 1.554 1.107 0 N-CA-C 112.735 0.643 . . . . 71.13 112.735 -173.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.703 HG11 HD21 ' A' ' 90' ' ' LEU . 61.1 t -92.62 -48.27 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.833 0 C-N-CA 122.984 0.513 . . . . 73.13 112.293 178.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 56.4 mt -78.78 151.11 5.12 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.221 0 C-N-CA 123.534 0.734 . . . . 73.41 110.793 -174.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -129.4 126.11 22.75 Favored Pre-proline 0 C--O 1.26 1.639 0 N-CA-C 109.085 -0.709 . . . . 72.35 109.085 172.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.643 ' HB3' HD22 ' A' ' 64' ' ' LEU . 14.5 Cg_endo -54.85 -23.24 33.14 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.451 2.101 . . . . 65.41 113.58 -173.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.2 p -60.92 -34.04 74.08 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 122.796 0.439 . . . . 62.52 112.137 -175.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.6 ptp180 -86.18 -28.47 23.9 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 120.892 -0.323 . . . . 75.22 111.736 -177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.48 HG12 ' HA ' ' A' ' 27' ' ' PRO . 21.3 pt -95.9 -16.19 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 N-CA-C 112.671 0.619 . . . . 72.12 112.671 -174.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.672 HG22 HD11 ' A' ' 40' ' ' LEU . 6.7 p -58.7 -44.09 98.6 Favored Pre-proline 0 N--CA 1.499 2.021 0 N-CA-C 114.243 1.201 . . . . 51.3 114.243 -179.171 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -64.88 -33.55 52.12 Favored 'Trans proline' 0 C--N 1.399 3.193 0 CA-C-N 121.674 1.634 . . . . 64.4 112.284 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 24.8 t80 -63.37 -54.26 39.58 Favored 'General case' 0 CA--C 1.55 0.968 0 CA-C-N 115.445 -0.798 . . . . 71.14 110.407 176.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 30' ' ' ILE . 71.8 mt -62.54 -26.49 68.6 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.545 0.738 . . . . 74.13 112.478 -179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.403 ' HG2' HD22 ' A' ' 40' ' ' LEU . 17.1 mmm180 -59.7 -52.43 65.54 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.296 0.638 . . . . 64.22 111.216 170.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -66.6 -27.98 68.14 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.591 0.756 . . . . 72.24 111.442 179.695 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 64.4 m -73.16 -14.02 61.28 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.529 0.732 . . . . 74.01 111.847 170.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.418 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.8 mmtt 70.83 18.33 6.17 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 125.114 1.366 . . . . 73.31 112.85 172.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 29.3 m -97.51 -28.42 3.72 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 C-N-CA 123.53 0.732 . . . . 63.51 111.613 176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.672 HD11 HG22 ' A' ' 31' ' ' THR . 9.2 tt -99.77 127.52 45.91 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.893 0.877 . . . . 75.12 110.055 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -84.99 158.32 58.9 Favored Pre-proline 0 N--CA 1.483 1.202 0 C-N-CA 123.728 0.811 . . . . 72.34 111.786 178.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.85 -25.14 78.02 Favored 'Trans proline' 0 C--N 1.38 2.218 0 C-N-CA 122.469 2.113 . . . . 54.23 112.736 174.086 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -73.18 -37.64 66.43 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.184 0.994 . . . . 73.22 111.05 172.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.425 ' O ' ' HG2' ' A' ' 47' ' ' GLN . 25.5 t0 -64.36 -60.14 3.53 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.556 -0.747 . . . . 74.43 111.945 -174.099 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.615 ' HB3' HD21 ' A' ' 40' ' ' LEU . 14.1 pt-20 -45.81 -36.06 4.9 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 113.72 1.007 . . . . 71.35 113.72 172.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -72.35 -44.84 62.02 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 112.415 0.524 . . . . 70.5 112.415 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 44' ' ' ASP . 9.9 pt20 -71.73 -39.89 69.78 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 111.529 0.196 . . . . 74.1 111.529 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.9 t -72.54 -27.84 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.706 0.802 . . . . 74.12 111.626 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -99.94 59.81 1.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 CA-C-O 121.343 0.592 . . . . 71.54 110.781 172.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.8 t -70.61 -33.87 71.5 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 115.422 -0.808 . . . . 53.0 109.531 170.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -118.97 106.56 43.35 Favored Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 125.164 1.386 . . . . 73.24 108.147 171.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -63.02 -23.17 73.97 Favored 'Trans proline' 0 N--CA 1.504 2.094 0 C-N-CA 122.926 2.417 . . . . 74.43 115.093 -177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 87.8 m-20 -83.35 175.22 10.03 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.742 0.817 . . . . 71.45 112.626 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.602 ' HB2' ' HD3' ' A' ' 57' ' ' ARG . 2.2 pt? -100.95 17.68 21.62 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.018 0.527 . . . . 73.21 112.126 -171.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 60.1 t -62.53 -55.1 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.394 0.678 . . . . 63.23 111.375 178.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 47.0 pt -107.94 25.24 2.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 C-N-CA 123.546 0.738 . . . . 71.23 112.27 -178.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.602 ' HD3' ' HB2' ' A' ' 54' ' ' LEU . 30.0 ptt180 -49.81 -24.41 2.39 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 113.953 1.094 . . . . 71.4 113.953 -179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' O ' ' HB ' ' A' ' 22' ' ' THR . 33.6 ttpt -65.27 -47.12 77.78 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.472 0.709 . . . . 65.41 112.381 179.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 9.6 ptm85 -76.61 -27.78 55.88 Favored 'General case' 0 N--CA 1.486 1.364 0 O-C-N 121.267 -0.896 . . . . 74.31 111.454 174.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -64.49 -49.29 71.93 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.812 0.845 . . . . 55.22 112.634 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.481 ' HB ' ' HA ' ' A' ' 22' ' ' THR . 49.2 t -72.0 -32.18 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 N-CA-C 110.272 -0.27 . . . . 52.03 110.272 175.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.02 -46.28 94.38 Favored Glycine 0 C--N 1.351 1.393 0 N-CA-C 113.411 0.124 . . . . 34.04 113.411 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.0 m -70.11 -31.24 46.84 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 122.426 0.29 . . . . 73.12 111.668 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.643 HD22 ' HB3' ' A' ' 27' ' ' PRO . 61.8 tp -64.42 -44.02 92.54 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.914 0.486 . . . . 75.04 112.269 175.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 98.9 mt -60.92 -37.68 83.15 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 123.43 0.692 . . . . 74.53 110.936 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -56.92 -43.04 81.03 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.19 0.996 . . . . 72.51 111.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 62.3 mt -75.7 -39.66 39.34 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.358 0 C-N-CA 123.382 0.673 . . . . 74.32 112.019 -178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 94.0 mt -68.23 -28.75 67.5 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.107 0.563 . . . . 74.43 111.304 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.462 ' NE2' ' HB3' ' A' ' 8' ' ' ASP . 53.2 tt0 -65.74 -32.65 74.31 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.379 0.672 . . . . 74.21 111.416 172.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 40.1 mtp-105 -62.96 -30.7 71.78 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 123.416 0.686 . . . . 71.25 111.618 175.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.9 p -79.52 -4.54 51.83 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 122.634 0.374 . . . . 34.32 110.98 178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.73 -138.24 15.48 Favored Glycine 0 C--N 1.355 1.59 0 C-N-CA 123.11 0.386 . . . . 74.52 113.686 178.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . 0.49 ' O ' HG23 ' A' ' 77' ' ' VAL . 13.7 t60 -73.06 -21.92 60.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.411 0.684 . . . . 75.22 110.75 178.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -58.3 -51.53 69.38 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.601 0.76 . . . . 73.31 112.649 179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.26 -35.48 92.13 Favored Glycine 0 N--CA 1.479 1.542 0 CA-C-N 116.519 -0.309 . . . . 61.24 113.38 176.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.529 ' O ' ' HG ' ' A' ' 80' ' ' LEU . 79.9 t80 -57.17 -53.14 61.46 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.792 0.837 . . . . 63.03 110.669 172.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 73' ' ' HIS . 81.2 t -56.1 -49.05 77.94 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.54 1.136 . . . . 52.11 111.141 177.699 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.26 77.49 Favored 'General case' 0 CA--C 1.548 0.904 0 CA-C-N 115.202 -0.908 . . . . 75.13 112.286 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 60.6 t80 -68.51 -40.0 81.03 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 122.851 0.46 . . . . 72.43 111.115 174.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 76' ' ' TYR . 40.4 mt -57.7 -51.71 68.42 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 120.959 0.409 . . . . 61.01 111.25 175.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -56.99 -44.26 82.53 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 125.034 1.334 . . . . 72.11 112.172 176.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 40.5 t -55.85 -45.19 78.51 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.179 -0.919 . . . . 71.42 110.892 174.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.624 ' HB3' ' HB2' ' A' ' 91' ' ' TYR . 10.8 mp -77.22 -18.62 57.55 Favored 'General case' 0 CA--C 1.557 1.235 0 N-CA-C 112.879 0.696 . . . . 75.23 112.879 177.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -65.71 -40.52 92.32 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.383 -0.823 . . . . 74.2 110.787 168.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 5.6 tt -85.45 -63.59 1.3 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 122.971 0.508 . . . . 73.32 110.736 -178.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -76.74 -52.4 9.66 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 113.942 1.09 . . . . 74.13 113.942 -170.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.534 ' HB3' ' HB2' ' A' ' 90' ' ' LEU . 93.6 m-85 -128.85 77.88 77.04 Favored Pre-proline 0 N--CA 1.497 1.9 0 N-CA-C 113.147 0.795 . . . . 71.13 113.147 -170.16 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -66.98 -27.92 42.3 Favored 'Trans proline' 0 C--N 1.378 2.091 0 C-N-CA 122.951 2.434 . . . . 73.31 113.481 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.445 ' HG3' HD22 ' A' ' 90' ' ' LEU . 14.8 pt20 -73.48 -44.84 57.01 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 123.876 0.87 . . . . 71.11 111.8 176.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.703 HD21 HG11 ' A' ' 24' ' ' VAL . 4.2 mm? -62.64 -27.38 69.18 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.26 0.624 . . . . 71.42 111.277 173.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.624 ' HB2' ' HB3' ' A' ' 83' ' ' LEU . 20.6 t80 -76.85 -45.63 27.69 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 116.418 -0.355 . . . . 73.1 110.501 174.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.37 -32.92 67.27 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.689 0.796 . . . . 71.32 111.97 179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.476 ' HE3' HG21 ' A' ' 20' ' ' THR . 0.3 OUTLIER -73.67 -48.81 29.49 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 112.717 0.636 . . . . 75.32 112.717 173.518 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.594 HG12 ' HB2' ' A' ' 17' ' ' PHE . 31.2 m -66.57 -33.58 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 N-CA-C 113.7 1.0 . . . . 74.02 113.7 -174.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.446 HG23 HG23 ' A' ' 94' ' ' VAL . 39.2 p -107.66 -49.06 3.3 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 122.654 0.382 . . . . 62.14 111.963 -178.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 103.85 17.79 15.7 Favored Glycine 0 N--CA 1.476 1.358 0 CA-C-N 116.107 -0.497 . . . . 42.33 112.391 -172.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.441 ' HE2' ' HA ' ' A' ' 100' ' ' ALA . 14.9 ptmt -132.95 151.32 52.07 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.115 0.966 . . . . 71.11 109.751 -177.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.584 ' HB2' ' HD3' ' A' ' 99' ' ' PRO . 35.6 mt-10 -88.98 -58.79 0.26 Allowed Pre-proline 0 CA--C 1.569 1.675 0 CA-C-O 118.829 -0.605 . . . . 74.21 110.513 176.144 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.584 ' HD3' ' HB2' ' A' ' 98' ' ' GLU . 43.1 Cg_endo -89.87 153.11 4.97 Favored 'Trans proline' 0 C--N 1.393 2.875 0 C-N-CA 121.785 1.657 . . . . 62.32 111.509 171.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.515 ' HB2' ' CE2' ' A' ' 91' ' ' TYR . . . -123.8 -25.62 4.25 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.7 1.0 . . . . 62.45 113.7 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.1 mtp180 57.21 59.22 3.48 Favored 'General case' 0 N--CA 1.483 1.21 0 CA-C-O 121.757 0.789 . . . . 71.13 112.252 -176.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 58.0 t -125.12 -13.67 4.97 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.657 0 CA-C-N 114.834 -1.076 . . . . 74.43 111.213 -170.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.467 ' O ' HG12 ' A' ' 107' ' ' ILE . 14.3 m-30 -52.04 -14.8 0.45 Allowed 'General case' 0 N--CA 1.506 2.363 0 N-CA-C 114.689 1.366 . . . . 74.41 114.689 179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 40.9 t -56.76 -22.92 39.31 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.799 0.84 . . . . 62.55 112.766 -179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 5.6 tpt -71.49 -58.24 3.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.094 0.958 . . . . 63.44 112.283 177.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -31.05 50.48 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.578 0.751 . . . . 63.32 109.862 178.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 103' ' ' PHE . 48.0 mm -67.29 -44.1 87.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 123.017 0.527 . . . . 74.15 111.335 171.469 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -71.2 -25.79 62.67 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 123.065 0.546 . . . . 70.11 112.125 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.418 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.52 -44.99 9.73 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.888 0.875 . . . . 75.42 113.042 -173.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.0 t -121.66 -4.22 9.24 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 123.35 0.66 . . . . 33.21 112.634 -176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 88.1 166.16 42.07 Favored Glycine 0 N--CA 1.475 1.25 0 C-N-CA 121.857 -0.211 . . . . 70.43 112.882 -173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.439 ' HA ' HD12 ' A' ' 107' ' ' ILE . 36.4 mt-10 -65.83 -37.05 85.17 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 122.902 0.481 . . . . 75.44 110.897 175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 80.7 p -60.41 -29.21 68.82 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.153 0.981 . . . . 73.22 111.659 172.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -65.6 -52.05 42.39 Favored Glycine 0 C--N 1.354 1.531 0 CA-C-O 120.795 0.108 . . . . 62.22 113.145 174.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.75 -30.14 70.75 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.896 0.479 . . . . 73.44 111.377 174.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 52.8 m -65.91 -42.09 90.63 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.362 0.665 . . . . 73.24 110.627 174.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -65.26 -39.86 93.19 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.347 0.659 . . . . 74.11 111.819 174.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 36.5 mt -57.19 -61.67 2.3 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.871 0.468 . . . . 61.11 110.783 173.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 69.2 mt -56.74 -46.2 81.52 Favored 'General case' 0 CA--C 1.562 1.442 0 C-N-CA 123.576 0.75 . . . . 61.44 112.155 -179.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.504 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -54.66 -46.29 73.98 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 114.479 1.288 . . . . 72.11 114.479 173.521 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.9 t -70.45 -36.62 74.04 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 119.956 -0.698 . . . . 70.43 111.028 176.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -73.64 -21.81 60.17 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.478 0.711 . . . . 72.15 112.73 -177.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.504 HG22 ' O ' ' A' ' 120' ' ' MET . 22.2 m -70.21 -25.3 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-N 118.91 0.777 . . . . 74.53 109.904 169.4 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.429 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 59.2 mtm -79.78 -40.01 29.62 Favored 'General case' 0 C--N 1.361 1.102 0 N-CA-C 109.535 -0.543 . . . . 64.33 109.535 177.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -58.65 -51.35 70.32 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.488 0.715 . . . . 73.22 111.181 174.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.4 mt -60.26 -41.08 92.49 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 114.684 -1.144 . . . . 73.25 112.596 174.134 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -62.38 -35.43 79.14 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 122.684 0.394 . . . . 73.23 111.504 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.429 ' HG2' ' O ' ' A' ' 124' ' ' MET . 75.1 mmtt -69.86 -36.32 75.43 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 122.734 0.414 . . . . 44.41 110.546 174.36 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 49.3 tptt -67.96 -36.09 79.48 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 122.625 0.37 . . . . 73.31 111.499 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 126' ' ' LEU . 64.3 t -66.58 -42.6 90.19 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.146 0 C-N-CA 123.147 0.579 . . . . 62.11 110.734 176.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.562 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.0 pt20 -70.5 -31.4 68.48 Favored 'General case' 0 N--CA 1.484 1.274 0 O-C-N 122.392 -0.193 . . . . 73.41 110.714 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.43 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 23.8 t70 -60.81 -36.12 78.24 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.31 1.044 . . . . 54.32 110.489 175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 29.8 mt -86.0 -40.97 15.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.583 -0.735 . . . . 75.35 112.167 -176.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.562 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.3 t -67.64 -32.12 72.6 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 118.091 0.405 . . . . 74.54 110.938 177.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.44 78.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.763 0.825 . . . . 42.54 112.046 174.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.581 ' HB2' HD11 ' B' ' 137' ' ' LEU . 35.5 mt -80.23 -45.47 17.93 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.25 -0.886 . . . . 63.34 110.763 -177.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.563 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.9 tt -49.11 -50.65 36.12 Favored 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 124.641 1.176 . . . . 45.45 110.902 174.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 67.4 m -66.46 -41.44 89.03 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 61.13 111.95 177.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 42.4 t -128.46 84.84 2.27 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.023 0.529 . . . . 74.34 112.257 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.13 168.57 11.86 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-O 121.193 0.521 . . . . 71.41 110.726 171.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -101.65 6.37 41.95 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.002 0.521 . . . . 62.43 111.749 -169.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 . . . . . 0 CA--C 1.563 1.465 0 C-N-CA 124.064 0.946 . . . . 73.44 111.733 -170.594 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 113.888 0.315 . . . . 64.41 113.888 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -71.77 -54.97 8.51 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.446 0.698 . . . . 74.14 111.52 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 18.4 m-20 -87.25 157.39 19.32 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.469 0.707 . . . . 72.11 111.337 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 44.9 m-85 -94.67 -48.98 5.83 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.113 0.965 . . . . 75.11 110.128 178.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -72.65 98.86 2.43 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-O 121.215 0.531 . . . . 72.3 111.196 178.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -159.94 171.93 18.49 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.121 0.968 . . . . 64.42 110.277 178.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -106.04 90.32 3.33 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.718 0.77 . . . . 63.54 112.348 -174.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.05 -25.41 32.12 Favored 'General case' 0 CA--C 1.553 1.068 0 CA-C-N 115.228 -0.896 . . . . 72.04 111.063 167.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -56.76 -50.85 71.03 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.464 1.106 . . . . 73.53 112.842 -168.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . 0.445 ' HB3' ' CE2' ' B' ' 76' ' ' TYR . 85.2 m -63.0 -33.37 75.27 Favored 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.527 0.566 . . . . 72.12 112.527 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 76.5 m95 -69.66 -22.58 63.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 113.817 1.043 . . . . 73.23 113.817 172.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 36.4 t -72.66 -21.95 61.0 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 120.992 0.425 . . . . 63.52 111.363 171.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 61.0 t -74.2 -42.21 51.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 C-N-CA 123.523 0.729 . . . . 75.23 110.882 172.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.432 HD21 HD21 ' B' ' 80' ' ' LEU . 45.3 mt -75.1 -35.25 61.78 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 112.664 0.616 . . . . 75.22 112.664 -179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.31 -36.1 77.12 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 123.079 0.552 . . . . 75.44 112.285 -173.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -61.68 -16.72 52.08 Favored Glycine 0 C--N 1.356 1.655 0 N-CA-C 114.602 0.601 . . . . 65.25 114.602 177.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -119.4 9.52 11.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.413 0.685 . . . . 74.53 111.392 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -66.19 -26.24 67.3 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 118.189 0.449 . . . . 61.41 112.078 -174.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 9.9 p -57.33 -36.22 51.84 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.466 0.707 . . . . 75.42 111.23 172.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.465 HG21 ' HE3' ' B' ' 93' ' ' LYS . 11.2 m -86.85 -38.18 17.03 Favored 'General case' 0 CA--C 1.552 1.021 0 C-N-CA 123.917 0.887 . . . . 50.45 110.967 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.694 HD23 HD12 ' B' ' 90' ' ' LEU . 92.3 mt -56.63 -42.75 79.4 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.307 0.643 . . . . 75.42 110.928 175.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' B' ' 58' ' ' LYS . 76.0 p -74.0 -28.07 61.27 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.687 0.795 . . . . 74.33 112.871 178.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.6 t -77.67 -39.79 43.77 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.39 0.676 . . . . 62.53 112.065 -179.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.485 HG11 HD21 ' B' ' 90' ' ' LEU . 72.3 t -93.33 -49.08 13.06 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 112.945 0.721 . . . . 51.11 112.945 -172.531 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mt -81.61 156.53 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 C-N-CA 123.211 0.604 . . . . 71.23 111.441 -172.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 9.5 t70 -132.04 117.77 16.1 Favored Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 109.315 -0.624 . . . . 71.51 109.315 171.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.652 ' HD2' ' HE2' ' B' ' 60' ' ' LYS . 73.0 Cg_exo -52.37 -20.73 12.1 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 124.001 3.134 . . . . 75.24 115.493 -172.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 98.4 p -63.9 -31.35 72.5 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.382 0.273 . . . . 60.45 110.993 -176.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 19.9 ptp180 -80.73 -35.72 33.04 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 111.54 0.2 . . . . 72.33 111.54 -178.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.47 HG12 ' HA ' ' B' ' 27' ' ' PRO . 15.8 pt -89.15 -19.8 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 N-CA-C 112.68 0.622 . . . . 71.22 112.68 -173.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 4.7 p -56.06 -45.48 99.9 Favored Pre-proline 0 N--CA 1.499 1.995 0 N-CA-C 114.471 1.285 . . . . 74.42 114.471 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_endo -62.59 -33.97 76.21 Favored 'Trans proline' 0 C--N 1.397 3.092 0 CA-C-N 121.835 1.691 . . . . 72.33 113.045 178.823 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -66.73 -51.46 55.67 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.931 0.492 . . . . 74.21 111.001 172.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 97.4 mt -60.09 -30.94 69.57 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.853 0.861 . . . . 71.5 112.953 -177.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 17.2 mmm-85 -60.8 -53.54 56.08 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.12 0.568 . . . . 61.54 110.491 170.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.665 ' HG3' HD21 ' B' ' 118' ' ' LEU . 13.5 mm100 -73.58 -16.21 61.26 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 123.651 0.78 . . . . 70.3 112.573 -179.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 61.5 m -77.38 -12.01 59.91 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.533 0.733 . . . . 60.21 110.362 169.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.625 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 72.4 mmtt 65.37 31.69 10.26 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 125.406 1.482 . . . . 61.23 111.931 176.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.497 HG12 ' HB3' ' B' ' 74' ' ' LYS . 25.6 m -111.96 -33.84 2.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.28 0.632 . . . . 74.21 110.883 178.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.521 HD11 HG22 ' B' ' 31' ' ' THR . 8.9 tt -95.34 129.17 42.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.115 0.966 . . . . 71.24 110.477 177.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -100.35 156.21 35.51 Favored Pre-proline 0 CA--C 1.557 1.23 0 C-N-CA 124.419 1.088 . . . . 70.21 110.27 177.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -51.86 -22.61 14.27 Favored 'Trans proline' 0 C--N 1.383 2.355 0 C-N-CA 123.392 2.728 . . . . 51.55 115.778 -178.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -74.73 -40.16 61.45 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 118.104 0.411 . . . . 75.15 111.721 175.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -62.83 -39.07 93.2 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.619 0.767 . . . . 54.02 112.833 -176.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.453 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.5 pt-20 -72.41 -29.58 63.86 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-N 116.507 -0.315 . . . . 70.22 111.094 179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -72.96 -46.65 51.2 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.073 0.549 . . . . 73.52 111.569 176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -71.72 -39.17 70.29 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 111.952 0.353 . . . . 75.33 111.952 -177.067 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.6 HG22 HG23 ' B' ' 63' ' ' VAL . 70.6 t -72.6 -47.94 48.76 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 C-N-CA 123.064 0.546 . . . . 70.14 111.344 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.528 HD13 ' HE3' ' B' ' 60' ' ' LYS . 3.9 mm? -88.2 71.03 9.25 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.37 0.605 . . . . 70.42 110.711 175.441 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 46.2 t -79.31 -28.81 42.17 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.794 0.807 . . . . 73.21 108.913 163.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -124.78 116.01 26.44 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 125.279 1.431 . . . . 71.51 108.983 175.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -77.19 -10.8 17.76 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 122.502 2.135 . . . . 74.43 112.529 174.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 21.6 m-80 -82.54 -179.02 7.28 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.007 0.923 . . . . 61.14 111.05 177.071 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.654 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.5 pt? -94.7 15.62 17.79 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 112.358 0.503 . . . . 71.35 112.358 178.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 55.9 t -66.62 -45.31 88.79 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.36 0 C-N-CA 123.076 0.55 . . . . 75.11 111.624 -174.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 45.1 pt -119.37 26.61 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 112.715 0.635 . . . . 64.42 112.715 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.489 ' HD3' ' HB2' ' B' ' 54' ' ' LEU . 35.5 ptt180 -50.12 -25.12 3.2 Favored 'General case' 0 N--CA 1.507 2.417 0 N-CA-C 113.312 0.856 . . . . 63.2 113.312 178.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.582 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 17.4 tppt? -58.47 -58.08 10.11 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.364 1.066 . . . . 72.25 111.96 175.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -74.63 -29.38 61.25 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 122.089 -0.382 . . . . 50.24 111.293 179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.652 ' HE2' ' HD2' ' B' ' 27' ' ' PRO . 47.2 mtpt -60.62 -61.56 2.5 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.8 0.84 . . . . 73.44 112.592 179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' B' ' 65' ' ' LEU . 41.1 t -60.63 -39.05 80.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 N-CA-C 110.109 -0.33 . . . . 64.31 110.109 178.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -57.59 -49.18 75.81 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.465 0.478 . . . . 73.31 114.071 -179.049 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.6 HG23 HG22 ' B' ' 48' ' ' VAL . 33.5 m -72.68 -28.64 28.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 116.932 0.366 . . . . 74.11 111.699 178.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.541 HD22 ' HB3' ' B' ' 27' ' ' PRO . 44.9 tp -67.12 -39.68 86.69 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 122.479 0.312 . . . . 71.32 111.647 174.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 93.1 mt -61.66 -39.56 91.8 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.198 0.599 . . . . 54.2 110.761 175.367 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -60.56 -39.44 88.0 Favored 'General case' 0 CA--C 1.561 1.372 0 C-N-CA 124.463 1.105 . . . . 72.41 111.448 174.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 77.7 mt -69.39 -47.84 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 124.394 1.077 . . . . 64.02 112.108 176.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 85.3 mt -71.21 -21.43 62.14 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.167 0.587 . . . . 60.31 111.439 -178.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -65.45 -33.26 75.52 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.642 0.777 . . . . 73.42 111.7 167.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 60.1 mtp180 -64.33 -26.76 68.62 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 122.62 0.368 . . . . 74.51 111.639 178.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p -92.36 -6.99 49.06 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.286 0.634 . . . . 74.33 111.561 176.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 68.47 -123.86 17.52 Favored Glycine 0 C--N 1.352 1.447 0 N-CA-C 114.443 0.537 . . . . 31.24 114.443 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 30.8 t60 -67.36 -27.84 67.45 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.634 0.774 . . . . 73.1 111.348 -174.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.497 ' HB3' HG12 ' B' ' 39' ' ' VAL . 26.5 mmmt -51.41 -65.74 0.5 Allowed 'General case' 0 CA--C 1.556 1.184 0 C-N-CA 124.396 1.078 . . . . 60.23 112.02 172.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.92 -32.72 83.55 Favored Glycine 0 C--N 1.351 1.361 0 CA-C-N 115.348 -0.842 . . . . 75.03 113.633 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.445 ' CE2' ' HB3' ' B' ' 10' ' ' CYS . 59.6 t80 -52.51 -65.22 0.6 Allowed 'General case' 0 CA--C 1.559 1.297 0 C-N-CA 123.856 0.862 . . . . 73.04 112.318 170.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 94.9 t -61.96 -38.59 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 CA-C-N 116.573 -0.285 . . . . 54.22 111.184 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.67 -50.7 72.92 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.335 0.654 . . . . 73.2 112.526 176.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -58.89 -50.53 73.68 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.526 0.73 . . . . 74.22 110.884 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.538 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 70.9 mt -62.25 -46.58 88.2 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 123.791 0.682 . . . . 64.53 112.644 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' B' ' 103' ' ' PHE . 21.5 tt0 -48.15 -54.13 14.39 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.593 1.157 . . . . 75.12 111.947 174.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 23.0 t -64.86 -38.77 92.1 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 122.071 0.939 . . . . 61.32 110.15 178.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 43.3 tp -60.77 -37.95 83.6 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 124.564 1.146 . . . . 62.3 112.353 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 44.9 mt-10 -67.48 -26.44 66.37 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.154 0.581 . . . . 71.33 111.536 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.529 ' HB2' ' HZ ' ' B' ' 103' ' ' PHE . 8.6 tt -76.45 -48.3 20.09 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.71 -0.677 . . . . 71.22 109.98 171.694 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 57.4 m-85 -81.45 -66.03 0.94 Allowed 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 113.416 0.895 . . . . 73.25 113.416 -175.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.585 ' HB3' HD23 ' B' ' 90' ' ' LEU . 77.4 m-85 -122.3 87.24 48.24 Favored Pre-proline 0 N--CA 1.487 1.413 0 C-N-CA 123.397 0.679 . . . . 64.1 111.667 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -69.05 -18.07 40.52 Favored 'Trans proline' 0 C--N 1.377 2.063 0 C-N-CA 122.564 2.176 . . . . 74.21 113.29 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 20.0 pt20 -75.66 -33.73 60.44 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.246 0.618 . . . . 71.13 111.86 175.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.694 HD12 HD23 ' B' ' 21' ' ' LEU . 4.1 mm? -66.28 -34.3 77.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.012 0.525 . . . . 52.22 110.786 172.034 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.463 ' HA ' HG22 ' B' ' 94' ' ' VAL . 56.1 t80 -70.08 -44.31 69.34 Favored 'General case' 0 CA--C 1.554 1.105 0 CA-C-O 120.715 0.293 . . . . 74.4 110.45 172.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -50.59 -47.08 58.18 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.405 1.082 . . . . 72.55 112.563 175.338 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.465 ' HE3' HG21 ' B' ' 20' ' ' THR . 0.5 OUTLIER -72.08 -46.45 56.75 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 112.587 0.588 . . . . 65.4 112.587 178.992 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.463 HG22 ' HA ' ' B' ' 91' ' ' TYR . 27.3 m -63.13 -34.3 65.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 N-CA-C 113.017 0.747 . . . . 54.4 113.017 -178.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.425 HG23 HG23 ' B' ' 94' ' ' VAL . 71.0 p -95.52 -37.88 10.68 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 112.69 0.626 . . . . 55.34 112.69 -178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.36 -1.6 69.85 Favored Glycine 0 CA--C 1.54 1.648 0 N-CA-C 114.39 0.516 . . . . 15.41 114.39 -178.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.23 -169.64 2.8 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 117.799 0.799 . . . . 73.23 111.834 -179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -54.77 143.43 50.48 Favored Pre-proline 0 N--CA 1.488 1.447 0 C-N-CA 124.518 1.127 . . . . 72.23 113.451 178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.453 ' HA ' ' CE2' ' B' ' 91' ' ' TYR . 32.1 Cg_exo -62.76 128.15 22.49 Favored 'Trans proline' 0 CA--C 1.561 1.859 0 C-N-CA 122.709 2.273 . . . . 64.31 113.372 167.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -87.38 -25.42 23.83 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.795 0.838 . . . . 42.12 112.407 -175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 34.5 ttp180 69.11 55.48 0.41 Allowed 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.608 1.563 . . . . 72.11 110.063 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.6 48.98 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.569 1.694 0 C-N-CA 124.972 1.309 . . . . 70.14 113.217 -172.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.529 ' HZ ' ' HB2' ' B' ' 85' ' ' LEU . 16.8 m-85 -68.53 3.61 1.74 Allowed 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.543 0.942 . . . . 71.32 113.543 176.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 58.4 p -64.26 -17.79 63.95 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.073 0.949 . . . . 75.01 112.758 175.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.0 tpp -65.22 -59.94 3.54 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.886 0.475 . . . . 74.23 110.568 172.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.517 HG21 HD13 ' B' ' 115' ' ' LEU . 0.0 OUTLIER -68.59 -26.15 32.58 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.377 0 C-N-CA 124.035 0.934 . . . . 62.44 111.309 179.957 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . . . . . . . . . 39.3 mm -68.84 -48.78 68.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 O-C-N 121.658 -0.651 . . . . 65.34 111.011 171.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -63.01 -33.65 75.87 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 122.095 -0.378 . . . . 64.34 111.603 175.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.625 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -81.1 -59.61 2.59 Favored 'General case' 0 CA--C 1.56 1.329 0 N-CA-C 113.513 0.931 . . . . 65.31 113.513 -175.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 64.1 m -111.22 5.45 19.97 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.829 0.851 . . . . 72.41 113.153 -175.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 83.38 171.86 48.06 Favored Glycine 0 N--CA 1.473 1.165 0 N-CA-C 114.271 0.468 . . . . 30.43 114.271 177.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -57.89 -47.4 82.9 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.679 0.791 . . . . 51.55 111.003 172.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 73.2 p -56.62 -41.28 76.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.327 1.051 . . . . 54.41 112.362 176.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -56.24 -57.71 17.88 Favored Glycine 0 C--N 1.352 1.433 0 O-C-N 123.221 0.325 . . . . 73.1 113.044 177.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.517 HD13 HG21 ' B' ' 106' ' ' ILE . 44.4 tp -64.0 -32.71 74.35 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 112.134 0.42 . . . . 74.52 112.134 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . 0.484 ' O ' ' HB2' ' B' ' 120' ' ' MET . 94.0 m -58.48 -41.15 84.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.649 0.38 . . . . 73.05 110.298 173.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -65.95 -50.1 65.57 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 123.69 0.796 . . . . 72.04 111.696 175.8 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.665 HD21 ' HG3' ' B' ' 36' ' ' GLN . 4.6 mm? -53.87 -47.35 71.13 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 123.159 0.584 . . . . 60.3 111.623 177.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.652 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 81.8 mt -70.99 -36.33 72.44 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.593 0.757 . . . . 74.35 112.23 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.484 ' HB2' ' O ' ' B' ' 116' ' ' THR . 0.0 OUTLIER -64.26 -41.39 96.97 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.054 0.541 . . . . 74.41 110.457 -178.772 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.1 t -74.96 -36.88 62.06 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 116.662 -0.244 . . . . 70.51 111.565 173.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -55.49 -44.46 76.53 Favored 'General case' 0 N--CA 1.495 1.797 0 C-N-CA 123.86 0.864 . . . . 73.43 112.431 178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 21.8 m -66.12 -24.59 34.01 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.048 0 CA-C-N 116.529 -0.305 . . . . 73.42 111.799 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.468 ' HB2' ' HE3' ' B' ' 124' ' ' MET . 54.3 mtm -81.99 -38.58 24.89 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.985 -0.376 . . . . 65.32 109.985 178.611 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -60.83 -38.44 85.47 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.659 0.783 . . . . 73.04 111.324 173.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.588 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 14.4 mt -70.5 -44.18 68.16 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.054 0.941 . . . . 53.42 111.103 174.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 9.5 tp-100 -58.83 -36.78 75.09 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.271 0.629 . . . . 62.14 111.725 175.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' B' ' 124' ' ' MET . 10.0 mmpt? -79.52 -33.72 41.79 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 122.604 0.362 . . . . 74.31 110.331 178.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . . . . . . . . . 56.0 tptt -61.36 -35.87 78.64 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.323 0.649 . . . . 42.42 110.771 172.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.427 HG23 ' O ' ' B' ' 126' ' ' LEU . 42.4 t -63.46 -53.38 46.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.445 0.698 . . . . 72.34 110.569 174.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.491 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.7 pt20 -62.75 -31.48 72.43 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 122.113 -0.367 . . . . 70.51 111.049 179.489 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -66.26 -38.69 88.44 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.27 1.028 . . . . 72.22 111.142 -179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -80.95 -41.03 23.53 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 116.001 -0.545 . . . . 71.32 111.011 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.491 HG22 ' HA ' ' B' ' 131' ' ' GLN . 3.1 t -67.15 -26.38 66.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.096 0.159 . . . . 62.33 110.896 177.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -64.02 -46.26 85.26 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 123.312 0.645 . . . . 74.32 110.648 173.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 137' ' ' LEU . 36.9 mt -81.88 -15.94 52.33 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 115.876 -0.602 . . . . 71.32 112.051 178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.581 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.4 tt -75.08 -54.21 7.55 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 108.911 -0.774 . . . . 72.41 108.911 175.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 68.2 m -69.31 -21.11 63.88 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.116 0.966 . . . . 74.12 112.685 176.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 68.1 m -144.59 89.59 2.01 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.527 0.731 . . . . 70.11 109.715 177.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 43.8 mtpt -78.72 167.01 21.84 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-O 121.65 0.738 . . . . 71.24 112.615 -179.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -82.03 -22.52 36.4 Favored 'General case' 0 CA--C 1.556 1.193 0 CA-C-N 114.623 -1.171 . . . . 51.42 111.225 179.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 . . . . . 0 CA--C 1.566 1.584 0 C-N-CA 123.775 0.83 . . . . 72.2 111.51 177.631 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.964 0 CA-C-O 119.8 -0.445 . . . . 74.14 112.322 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.6 m -157.73 164.64 36.89 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.68 0.792 . . . . 73.52 111.209 177.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -93.1 -75.52 0.49 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.249 0.62 . . . . 72.41 111.175 178.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -94.52 -22.38 18.27 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.918 0.887 . . . . 63.31 111.994 -173.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 59.4 mm-40 -61.47 134.09 56.48 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.363 0.665 . . . . 54.42 112.353 -178.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -84.58 11.49 8.73 Favored 'General case' 0 CA--C 1.567 1.602 0 C-N-CA 123.636 0.774 . . . . 72.04 111.986 179.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -56.63 135.89 54.83 Favored 'General case' 0 CA--C 1.557 1.214 0 C-N-CA 124.891 1.276 . . . . 73.33 113.625 -174.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.453 ' HB3' ' HA2' ' A' ' 72' ' ' GLY . 4.2 p30 -82.15 -13.45 57.18 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 122.857 0.463 . . . . 74.54 111.766 167.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -55.88 -30.6 61.8 Favored 'General case' 0 N--CA 1.494 1.77 0 C-N-CA 124.504 1.121 . . . . 64.43 113.213 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.8 p -56.88 -26.56 59.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.286 1.035 . . . . 71.05 113.253 175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -52.11 -18.65 1.54 Allowed 'General case' 0 N--CA 1.498 1.942 0 N-CA-C 114.184 1.179 . . . . 75.1 114.184 172.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -57.23 -31.95 66.03 Favored 'General case' 0 N--CA 1.494 1.761 0 N-CA-C 112.801 0.667 . . . . 63.21 112.801 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.3 t -61.45 -40.84 87.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 C-N-CA 123.666 0.786 . . . . 74.31 111.244 174.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 93.1 mt -81.37 -35.03 31.32 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.05 0.54 . . . . 72.25 112.305 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -48.82 -54.73 13.96 Favored 'General case' 0 N--CA 1.496 1.844 0 C-N-CA 125.11 1.364 . . . . 72.43 113.929 -171.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -59.96 -22.74 58.21 Favored Glycine 0 CA--C 1.538 1.521 0 N-CA-C 114.088 0.395 . . . . 74.12 114.088 179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -106.7 -5.13 18.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.988 0.915 . . . . 71.22 112.245 178.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.429 ' HA ' HD12 ' A' ' 21' ' ' LEU . 14.9 ptt180 -63.07 -33.04 74.58 Favored 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 118.577 0.626 . . . . 61.45 111.538 -169.061 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 7.1 p -58.88 -33.22 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.48 0 C-N-CA 124.157 0.983 . . . . 64.01 111.852 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.1 m -85.85 -35.75 20.42 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.472 0.709 . . . . 51.5 111.104 175.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.609 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -61.99 -30.34 70.87 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.575 0.75 . . . . 63.34 111.563 176.165 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.404 HG22 ' HB ' ' A' ' 61' ' ' VAL . 67.6 p -80.41 -19.16 46.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.443 0.697 . . . . 74.21 112.607 176.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.435 ' HB2' ' NZ ' ' A' ' 58' ' ' LYS . 21.6 t -84.4 -38.42 20.27 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 123.181 0.592 . . . . 71.13 111.462 174.955 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG11 HD21 ' A' ' 90' ' ' LEU . 48.6 t -88.99 -53.56 9.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.315 0.646 . . . . 73.13 112.199 -176.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.589 HG12 HD11 ' A' ' 83' ' ' LEU . 3.6 mp -87.37 141.69 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 N-CA-C 108.737 -0.838 . . . . 73.41 108.737 -177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -130.72 129.64 22.73 Favored Pre-proline 0 C--O 1.257 1.454 0 N-CA-C 109.291 -0.633 . . . . 72.35 109.291 175.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.659 ' HB3' HD22 ' A' ' 64' ' ' LEU . 26.4 Cg_endo -56.8 -14.65 14.29 Favored 'Trans proline' 0 C--N 1.388 2.641 0 C-N-CA 123.903 3.069 . . . . 65.41 113.742 -172.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.9 p -69.06 -37.87 78.78 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 123.358 0.663 . . . . 62.52 110.483 -175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -90.5 -5.81 55.55 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 112.538 0.57 . . . . 75.22 112.538 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 30.9 pt -118.95 8.3 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.835 0.454 . . . . 72.12 111.797 179.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.536 HG23 ' O ' ' A' ' 27' ' ' PRO . 16.8 p -53.59 -52.66 65.01 Favored Pre-proline 0 N--CA 1.495 1.785 0 CA-C-O 117.938 -1.03 . . . . 51.3 112.989 175.63 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.444 ' O ' ' HG2' ' A' ' 36' ' ' GLN . 92.6 Cg_endo -73.69 -26.87 13.26 Favored 'Trans proline' 0 C--N 1.395 3.017 0 CA-C-N 121.694 1.641 . . . . 64.4 112.358 -177.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -61.93 -58.5 7.66 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.957 0.503 . . . . 71.14 109.735 176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 81.6 mt -68.34 -22.66 64.67 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 115.332 -0.849 . . . . 74.13 112.639 -178.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 19.2 mmm180 -62.74 -50.77 69.76 Favored 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 122.849 0.46 . . . . 64.22 110.481 168.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 32' ' ' PRO . 12.8 mm100 -67.01 -27.63 67.58 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.144 0.578 . . . . 72.24 111.784 177.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 62.6 m -75.35 -11.33 60.03 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.48 0.712 . . . . 74.01 111.73 171.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt 71.52 13.9 6.36 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.184 1.393 . . . . 73.31 113.075 173.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.9 m -98.16 -35.7 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.204 0 C-N-CA 123.436 0.695 . . . . 63.51 111.904 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.593 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.3 tt -86.11 124.04 32.08 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.723 0.809 . . . . 75.12 110.074 177.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 -79.37 154.25 76.72 Favored Pre-proline 0 N--CA 1.484 1.246 0 C-N-CA 123.761 0.824 . . . . 72.34 111.772 177.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.17 -26.3 81.26 Favored 'Trans proline' 0 C--N 1.378 2.128 0 C-N-CA 122.121 1.881 . . . . 54.23 112.483 171.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -73.7 -39.74 64.14 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.323 1.049 . . . . 73.22 110.957 174.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -56.4 -66.55 0.42 Allowed 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.941 0.896 . . . . 74.43 111.221 -177.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.593 ' HB3' HD21 ' A' ' 40' ' ' LEU . 9.8 pt-20 -42.94 -31.33 0.5 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 114.279 1.215 . . . . 71.35 114.279 175.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -77.22 -52.52 9.09 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.911 0.484 . . . . 70.5 112.226 176.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -71.58 -39.96 70.22 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 112.328 0.492 . . . . 74.1 112.328 -175.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.589 HG22 HG12 ' A' ' 63' ' ' VAL . 42.8 t -71.12 -31.11 43.59 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 C-N-CA 124.467 1.107 . . . . 74.12 111.664 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -106.46 17.96 22.61 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.492 -0.755 . . . . 71.54 112.442 175.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 31.1 t -60.63 -33.67 73.13 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 122.709 0.403 . . . . 53.0 111.406 174.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -93.82 108.33 34.01 Favored Pre-proline 0 CA--C 1.554 1.122 0 C-N-CA 123.424 0.69 . . . . 73.24 110.556 170.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -72.08 -27.13 17.41 Favored 'Trans proline' 0 C--N 1.376 1.976 0 C-N-CA 122.594 2.196 . . . . 74.43 112.982 177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -73.16 142.59 47.42 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.184 0.593 . . . . 71.45 112.26 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.608 ' HB2' ' HD2' ' A' ' 57' ' ' ARG . 2.2 pt? -77.66 2.04 17.97 Favored 'General case' 0 CA--C 1.559 1.311 0 C-N-CA 123.533 0.733 . . . . 73.21 112.629 178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.3 t -53.73 -50.28 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 C-N-CA 124.088 0.955 . . . . 63.23 112.025 -179.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 45.5 pt -107.31 22.6 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.101 0 N-CA-C 112.497 0.554 . . . . 71.23 112.497 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.64 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 7.5 ptm180 -61.1 -25.12 66.74 Favored 'General case' 0 N--CA 1.495 1.776 0 CA-C-N 118.452 0.569 . . . . 71.4 111.739 -175.658 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.435 ' NZ ' ' HB2' ' A' ' 23' ' ' SER . 16.9 tppt? -59.37 -44.45 92.72 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.088 0.955 . . . . 65.41 111.56 176.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' HG23 ' A' ' 63' ' ' VAL . 10.6 ptm180 -87.02 -26.84 23.55 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 122.185 -0.322 . . . . 74.31 111.545 174.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.64 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 29.5 ttpp -67.49 -43.98 79.62 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.147 0.979 . . . . 55.22 112.409 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.485 HG23 ' O ' ' A' ' 57' ' ' ARG . 16.4 t -71.56 -23.54 22.73 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 CA-C-O 121.128 0.489 . . . . 52.03 110.087 174.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.75 -23.0 58.81 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.209 -0.756 . . . . 34.04 111.209 -179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.589 HG12 HG22 ' A' ' 48' ' ' VAL . 14.2 t -63.4 -47.11 93.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.008 0 C-N-CA 124.433 1.093 . . . . 73.12 109.277 169.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.659 HD22 ' HB3' ' A' ' 27' ' ' PRO . 38.8 tp -55.04 -54.01 48.45 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.138 0.575 . . . . 75.04 111.487 169.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 86.9 mt -56.56 -37.48 70.6 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 123.518 0.727 . . . . 74.53 112.399 -177.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -67.3 -38.17 84.56 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.917 0.887 . . . . 72.51 111.451 177.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.445 ' HA ' ' HG2' ' A' ' 70' ' ' ARG . 64.8 mt -78.45 -22.26 13.25 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.595 0 C-N-CA 123.156 0.582 . . . . 74.32 111.175 176.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 62.7 mt -81.7 -24.69 36.03 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 121.576 -0.703 . . . . 74.43 110.447 171.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -67.8 -34.41 76.71 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.601 0.76 . . . . 74.21 111.325 174.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 67' ' ' ILE . 14.9 ptm180 -82.51 -9.04 59.58 Favored 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 122.52 0.328 . . . . 71.25 111.738 179.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.7 p -88.49 -3.48 58.81 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 120.896 0.379 . . . . 34.32 110.325 165.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 8' ' ' ASP . . . 82.18 -135.69 14.58 Favored Glycine 0 C--N 1.353 1.522 0 N-CA-C 114.536 0.575 . . . . 74.52 114.536 172.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.1 t60 -67.75 -24.17 65.32 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.135 0.974 . . . . 75.22 110.988 177.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -64.33 -51.1 65.06 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.099 0.559 . . . . 73.31 112.216 -178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.72 96.79 Favored Glycine 0 N--CA 1.481 1.645 0 O-C-N 123.039 0.212 . . . . 61.24 112.983 177.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.27 -59.58 4.38 Favored 'General case' 0 CA--C 1.558 1.284 0 C-N-CA 124.375 1.07 . . . . 63.03 112.636 171.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 70.8 t -56.93 -45.88 83.68 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 C-N-CA 123.43 0.692 . . . . 52.11 111.132 177.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.71 -38.11 83.94 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.571 0.749 . . . . 75.13 112.563 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.437 ' HE1' HD13 ' A' ' 21' ' ' LEU . 62.5 t80 -70.27 -45.52 66.22 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 122.373 0.269 . . . . 72.43 111.067 176.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.46 ' O ' ' HG3' ' A' ' 84' ' ' GLU . 96.1 mt -55.81 -49.33 73.53 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 121.323 0.582 . . . . 61.01 111.254 174.294 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.17 -43.97 98.04 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 126.166 1.787 . . . . 72.11 112.355 -177.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 91.3 p -62.39 -44.57 96.13 Favored 'General case' 0 N--CA 1.481 1.08 0 CA-C-N 116.651 -0.249 . . . . 71.42 110.454 173.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.589 HD11 HG12 ' A' ' 25' ' ' ILE . 9.2 mp -60.11 -34.82 74.03 Favored 'General case' 0 N--CA 1.491 1.593 0 N-CA-C 112.325 0.491 . . . . 75.23 112.325 175.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 80' ' ' LEU . 57.6 mt-10 -63.57 -25.6 68.31 Favored 'General case' 0 N--CA 1.488 1.447 0 CA-C-N 118.279 0.491 . . . . 74.2 111.419 176.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.4 tt -80.07 -61.74 1.89 Allowed 'General case' 0 CA--C 1.561 1.39 0 N-CA-C 109.632 -0.506 . . . . 73.32 109.632 169.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -77.62 -63.77 1.3 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.982 0.913 . . . . 74.13 113.015 -169.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.62 ' HB3' HD23 ' A' ' 90' ' ' LEU . 85.3 m-85 -119.5 82.52 25.26 Favored Pre-proline 0 N--CA 1.491 1.605 0 C-N-CA 123.24 0.616 . . . . 71.13 111.778 -172.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -63.95 -31.8 66.29 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.962 2.441 . . . . 73.31 113.513 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.412 ' HG3' HD22 ' A' ' 90' ' ' LEU . 11.3 pt20 -72.69 -31.87 65.36 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.742 0.417 . . . . 71.11 111.881 177.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.62 HD23 ' HB3' ' A' ' 87' ' ' TYR . 4.2 mm? -65.3 -32.7 74.5 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.631 0.372 . . . . 71.42 111.327 172.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.449 ' CE2' ' HA ' ' A' ' 99' ' ' PRO . 73.1 t80 -70.38 -46.96 63.01 Favored 'General case' 0 CA--C 1.559 1.314 0 N-CA-C 110.287 -0.264 . . . . 73.1 110.287 170.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.441 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 59.1 mmtt -50.57 -44.79 56.81 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 124.328 1.051 . . . . 71.32 112.54 177.036 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.595 ' HD3' HD13 ' A' ' 90' ' ' LEU . 21.0 ptmt -76.54 -44.4 35.1 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 112.565 0.58 . . . . 75.32 112.565 -176.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.593 HG23 HG23 ' A' ' 95' ' ' THR . 20.9 m -62.15 -41.92 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 CA-C-N 118.446 0.567 . . . . 74.02 112.414 178.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.593 HG23 HG23 ' A' ' 94' ' ' VAL . 68.4 p -91.76 -44.17 9.13 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 122.612 0.365 . . . . 62.14 111.98 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 89.87 13.8 60.33 Favored Glycine 0 N--CA 1.478 1.456 0 CA-C-N 116.094 -0.503 . . . . 42.33 113.395 -174.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.72 170.19 16.34 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.442 0.697 . . . . 71.11 111.677 -177.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.22 148.28 93.35 Favored Pre-proline 0 CA--C 1.56 1.335 0 C-N-CA 124.04 0.936 . . . . 74.21 111.403 177.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.449 ' HA ' ' CE2' ' A' ' 91' ' ' TYR . 65.9 Cg_exo -52.81 115.25 2.13 Favored 'Trans proline' 0 C--N 1.378 2.131 0 C-N-CA 122.564 2.176 . . . . 62.32 112.78 175.526 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.55 -29.16 66.68 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 121.355 0.598 . . . . 62.45 111.113 -177.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.527 ' HD2' ' HE2' ' A' ' 103' ' ' PHE . 37.8 mmt180 74.66 52.22 0.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.817 1.647 . . . . 71.13 109.914 174.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 3.5 t -77.83 44.23 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.566 1.583 0 C-N-CA 124.365 1.066 . . . . 74.43 111.852 -178.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HE2' ' HD2' ' A' ' 101' ' ' ARG . 60.2 m-85 -65.8 -8.63 22.63 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.93 0.892 . . . . 74.41 112.552 178.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.517 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 27.7 t -62.57 -18.18 61.56 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.704 0.802 . . . . 62.55 111.717 174.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 10.6 tpt -66.31 -61.99 1.71 Allowed 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 122.93 0.492 . . . . 63.44 110.87 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -65.82 -28.32 43.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.453 0 C-N-CA 123.896 0.879 . . . . 63.32 110.441 176.964 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.666 HG13 ' HG3' ' A' ' 112' ' ' GLU . 1.2 mp -61.29 -49.81 83.04 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.651 0 C-N-CA 122.862 0.465 . . . . 74.15 111.406 172.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -78.56 -21.91 47.97 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.187 -0.946 . . . . 70.11 113.265 176.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -77.28 -53.55 7.57 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.052 0.541 . . . . 75.42 111.784 -179.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 34.4 t -108.04 -40.43 5.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.214 0.606 . . . . 33.21 111.992 179.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 132.3 157.1 8.48 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.642 -0.708 . . . . 70.43 111.386 -169.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.666 ' HG3' HG13 ' A' ' 107' ' ' ILE . 1.9 mp0 -59.76 -39.15 83.86 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 117.482 0.641 . . . . 75.44 110.357 172.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 77.3 p -59.71 -29.55 68.19 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.975 0.91 . . . . 73.22 112.27 174.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.23 -57.64 18.13 Favored Glycine 0 C--N 1.347 1.159 0 O-C-N 123.047 0.217 . . . . 62.22 112.574 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 106' ' ' ILE . 31.5 tp -67.43 -27.63 67.21 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 122.707 0.403 . . . . 73.44 111.947 176.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . 0.45 ' O ' ' HB2' ' A' ' 120' ' ' MET . 51.1 m -61.42 -44.08 97.76 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.103 0.561 . . . . 73.24 109.949 173.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -68.33 -42.59 79.1 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.46 0.704 . . . . 74.11 112.018 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 96.8 mt -58.91 -47.65 84.24 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 122.981 0.513 . . . . 61.11 111.467 176.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 58.1 mt -67.99 -44.93 75.49 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.566 0.746 . . . . 61.44 111.616 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.48 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -59.09 -42.37 90.28 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 123.962 0.905 . . . . 72.11 111.155 -178.891 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -71.6 -38.74 70.82 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 121.962 -0.461 . . . . 70.43 111.294 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -64.49 -28.04 69.39 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 112.207 0.447 . . . . 72.15 112.207 -178.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.513 HG13 ' O ' ' A' ' 119' ' ' LEU . 4.3 m -72.99 -25.38 21.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 O-C-N 122.261 -0.274 . . . . 74.53 110.587 174.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 61.5 mtm -78.83 -34.97 44.77 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 122.746 0.418 . . . . 64.33 109.955 177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -56.69 -56.03 26.57 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.426 1.09 . . . . 73.22 110.494 172.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 19.8 mt -63.33 -39.9 95.84 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.336 -1.302 . . . . 73.25 112.729 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -62.55 -36.0 81.23 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 121.153 0.501 . . . . 73.23 111.07 177.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -71.19 -41.55 70.14 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 115.641 -0.709 . . . . 44.41 110.846 174.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.464 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 57.5 tptt -63.76 -37.77 88.6 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.139 0.976 . . . . 73.31 111.532 179.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 126' ' ' LEU . 54.9 t -65.3 -46.65 89.91 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.062 0 C-N-CA 123.492 0.717 . . . . 62.11 110.269 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.522 ' HA ' HG22 ' A' ' 134' ' ' THR . 3.2 tt0 -60.81 -39.14 87.82 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.82 0.848 . . . . 73.41 112.124 175.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.474 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 19.4 t70 -61.55 -54.16 46.8 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.603 -0.517 . . . . 54.32 109.603 179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.4 mt -64.03 -39.92 95.17 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 115.734 -0.666 . . . . 75.35 111.958 -179.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.522 HG22 ' HA ' ' A' ' 131' ' ' GLN . 1.3 t -69.26 -29.03 66.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 122.826 0.45 . . . . 74.54 111.098 -177.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -69.84 -43.81 71.2 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.09 0.556 . . . . 42.54 110.613 172.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 132' ' ' ASP . 54.8 mt -73.83 -19.82 60.63 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.707 0.803 . . . . 63.34 111.587 177.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.538 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.9 OUTLIER -81.15 -59.06 2.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 124.109 0.963 . . . . 45.45 108.726 178.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.4 t -55.57 -36.41 66.82 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.312 1.045 . . . . 61.13 112.557 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.0 t -121.11 70.99 0.93 Allowed 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 108.385 -0.968 . . . . 74.34 108.385 175.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 57.1 tttm -77.62 146.12 36.35 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.613 0.765 . . . . 71.41 112.858 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 60.86 7.03 1.33 Allowed 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 125.049 1.339 . . . . 62.43 113.383 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 31.9 t70 . . . . . 0 CA--C 1.558 1.261 0 C-N-CA 123.064 0.546 . . . . 73.44 110.83 -172.031 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.033 0 N-CA-C 112.782 -0.127 . . . . 64.41 112.782 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 70.2 m -120.81 90.99 3.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.63 0.772 . . . . 74.14 109.877 177.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -98.86 148.37 24.0 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.552 0.741 . . . . 72.11 110.694 -177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -109.88 95.69 5.76 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.994 0.918 . . . . 75.11 109.674 177.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 -107.0 166.48 10.58 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.653 -1.158 . . . . 72.3 112.206 -179.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 7.0 p30 -104.97 21.91 16.2 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.414 1.086 . . . . 64.42 110.457 171.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -66.26 128.98 38.25 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.402 1.081 . . . . 63.54 113.293 -168.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -75.48 -15.42 60.41 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.045 0.538 . . . . 72.04 111.665 169.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.5 -39.54 84.16 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.4 1.08 . . . . 73.53 113.238 -175.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.0 p -59.91 -24.44 64.33 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.546 0.943 . . . . 72.12 113.546 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 48.4 m95 -49.45 -20.22 0.68 Allowed 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 114.188 1.181 . . . . 73.23 114.188 172.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -48.03 -32.0 6.12 Favored 'General case' 0 N--CA 1.503 2.201 0 CA-C-N 119.163 0.892 . . . . 63.52 112.723 174.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 96.6 t -67.02 -52.25 45.81 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.538 0 C-N-CA 124.719 1.208 . . . . 75.23 111.9 175.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 92.0 mt -77.64 -57.38 3.84 Favored 'General case' 0 N--CA 1.499 1.982 0 C-N-CA 123.381 0.672 . . . . 75.22 112.171 -178.642 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -44.52 -45.76 9.48 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 125.88 1.672 . . . . 75.44 114.522 -178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.41 -19.33 40.18 Favored Glycine 0 CA--C 1.545 1.917 0 N-CA-C 114.899 0.719 . . . . 65.25 114.899 177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.5 m-85 -102.86 24.67 10.32 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.016 0.926 . . . . 74.53 112.064 174.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.2 ttm180 -52.3 -43.59 64.57 Favored 'General case' 0 N--CA 1.492 1.664 0 CA-C-N 118.666 0.666 . . . . 61.41 112.087 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.2 p -54.8 -30.84 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 C-N-CA 123.623 0.769 . . . . 75.42 112.204 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 43.0 m -85.5 -50.12 7.52 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.103 0.961 . . . . 50.45 111.658 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.429 ' HA ' HD13 ' B' ' 25' ' ' ILE . 86.0 mt -59.6 -39.52 84.48 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.04 0.936 . . . . 75.42 112.124 -174.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.524 HG22 ' HB ' ' B' ' 61' ' ' VAL . 70.1 p -71.41 -29.51 65.0 Favored 'General case' 0 N--CA 1.484 1.233 0 N-CA-C 113.032 0.753 . . . . 74.33 113.032 179.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 50.9 m -84.11 -38.03 21.26 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.205 0.602 . . . . 62.53 112.26 -179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.589 HG11 HD21 ' B' ' 90' ' ' LEU . 42.0 t -94.3 -48.17 13.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 122.826 0.45 . . . . 51.11 112.104 -174.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . 0.429 HD13 ' HA ' ' B' ' 21' ' ' LEU . 3.8 mp -92.44 129.89 42.35 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 N-CA-C 109.682 -0.488 . . . . 71.23 109.682 -178.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -122.2 121.55 27.82 Favored Pre-proline 0 C--O 1.253 1.257 0 N-CA-C 108.715 -0.846 . . . . 71.51 108.715 179.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.478 ' HD2' ' HE3' ' B' ' 60' ' ' LYS . 30.5 Cg_exo -41.41 -22.34 0.15 Allowed 'Trans proline' 0 C--N 1.379 2.145 0 C-N-CA 124.973 3.782 . . . . 75.24 117.163 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 79.1 p -66.48 -25.94 66.95 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 118.45 0.568 . . . . 60.45 111.22 -174.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.522 ' HG3' HG23 ' B' ' 30' ' ' ILE . 9.4 ptp180 -89.96 -38.9 13.33 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 112.885 0.698 . . . . 72.33 112.885 177.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.522 HG23 ' HG3' ' B' ' 29' ' ' ARG . 32.6 pt -88.58 -19.87 7.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 113.482 0.919 . . . . 71.22 113.482 -170.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.521 HG22 HD11 ' B' ' 40' ' ' LEU . 17.2 p -56.84 -44.08 99.63 Favored Pre-proline 0 N--CA 1.5 2.053 0 N-CA-C 114.358 1.244 . . . . 74.42 114.358 -178.155 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -66.97 -32.5 35.05 Favored 'Trans proline' 0 C--N 1.394 2.971 0 CA-C-N 121.728 1.653 . . . . 72.33 113.363 175.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -64.69 -51.15 63.98 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.115 0.566 . . . . 74.21 110.799 174.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.494 HD13 HD21 ' B' ' 68' ' ' LEU . 87.2 mt -62.88 -22.97 67.1 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.449 1.1 . . . . 71.5 112.415 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 39.2 mmm-85 -60.99 -50.18 74.43 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.264 0.626 . . . . 61.54 110.557 169.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.453 ' HG3' HD11 ' B' ' 118' ' ' LEU . 12.7 mm100 -69.85 -22.7 63.24 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 115.229 -0.896 . . . . 70.3 111.643 179.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 20.7 m -76.81 -13.75 59.98 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 123.342 0.657 . . . . 60.21 111.061 170.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.61 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 74.4 mmtt 68.43 8.06 6.4 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 125.388 1.475 . . . . 61.23 113.015 177.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . 0.487 HG12 ' HB3' ' B' ' 74' ' ' LYS . 24.0 m -87.73 -31.82 5.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.977 0 C-N-CA 123.664 0.786 . . . . 74.21 110.479 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.655 HD12 HD11 ' B' ' 64' ' ' LEU . 10.3 tt -103.37 135.26 45.32 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.484 1.114 . . . . 71.24 109.73 173.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.9 m-80 -111.39 162.26 21.74 Favored Pre-proline 0 CA--C 1.565 1.548 0 C-N-CA 124.239 1.016 . . . . 70.21 110.163 -176.683 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -49.05 -47.61 21.13 Favored 'Trans proline' 0 C--N 1.387 2.564 0 C-N-CA 123.265 2.643 . . . . 51.55 115.362 -176.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -63.59 -29.77 70.98 Favored 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 112.342 0.497 . . . . 75.15 112.342 -178.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -64.98 -61.81 1.94 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.935 0.494 . . . . 54.02 111.693 176.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.556 ' HB3' HD21 ' B' ' 40' ' ' LEU . 9.0 pt-20 -53.53 -25.89 18.77 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 113.28 0.844 . . . . 70.22 113.28 174.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -69.88 -52.78 21.88 Favored 'General case' 0 N--CA 1.488 1.451 0 CA-C-N 118.252 0.478 . . . . 73.52 111.927 173.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -70.01 -29.62 66.74 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 122.536 0.335 . . . . 75.33 111.779 -177.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 60.3 t -74.87 -51.91 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.441 0 C-N-CA 124.481 1.112 . . . . 70.14 111.303 175.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.2 mm? -82.2 17.48 1.64 Allowed 'General case' 0 N--CA 1.502 2.128 0 C-N-CA 123.279 0.632 . . . . 70.42 112.263 177.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 37.4 t -68.04 -4.31 12.99 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.951 0.901 . . . . 73.21 112.452 170.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -133.39 84.25 47.19 Favored Pre-proline 0 CA--C 1.56 1.332 0 C-N-CA 124.192 0.997 . . . . 71.51 109.64 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -77.03 -21.15 12.44 Favored 'Trans proline' 0 CA--C 1.56 1.782 0 C-N-CA 122.764 2.309 . . . . 74.43 112.937 174.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -86.74 19.24 3.01 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.651 0.78 . . . . 61.14 113.092 -179.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.658 ' HB2' ' HD2' ' B' ' 57' ' ' ARG . 0.6 OUTLIER 39.31 43.01 0.88 Allowed 'General case' 0 N--CA 1.498 1.936 0 C-N-CA 126.031 1.732 . . . . 71.35 115.146 175.729 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 71.6 t -72.43 -45.21 60.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 C-N-CA 123.507 0.723 . . . . 75.11 110.494 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.8 pp -120.98 24.96 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 C-N-CA 124.582 1.153 . . . . 64.42 112.134 -177.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.658 ' HD2' ' HB2' ' B' ' 54' ' ' LEU . 12.2 ptm180 -50.3 -28.27 7.54 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 114.147 1.166 . . . . 63.2 114.147 -174.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.469 ' HD3' ' HB ' ' B' ' 22' ' ' THR . 3.7 tppp? -65.33 -54.52 27.8 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.769 0.828 . . . . 72.25 111.435 178.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -72.23 -19.74 61.66 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 122.34 0.256 . . . . 50.24 111.525 176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.478 ' HE3' ' HD2' ' B' ' 27' ' ' PRO . 34.2 ttpt -61.94 -40.95 97.31 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.254 0.622 . . . . 73.44 110.835 175.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.524 ' HB ' HG22 ' B' ' 22' ' ' THR . 4.2 t -67.94 -44.4 85.09 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-N 116.245 -0.434 . . . . 64.31 109.997 173.514 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -58.88 -40.88 95.8 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 115.531 -0.759 . . . . 73.31 114.174 -178.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -77.02 -26.46 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-N 116.934 0.367 . . . . 74.11 110.743 -179.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.655 HD11 HD12 ' B' ' 40' ' ' LEU . 46.3 tp -70.07 -40.28 75.14 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 122.254 0.222 . . . . 71.32 110.991 173.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -57.6 -39.38 76.71 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.008 0.523 . . . . 54.2 110.949 174.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -59.82 -48.25 82.44 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.291 1.037 . . . . 72.41 111.427 171.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 82.1 mt -57.63 -39.93 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 C-N-CA 124.121 0.968 . . . . 64.02 111.776 176.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.494 HD21 HD13 ' B' ' 34' ' ' LEU . 77.4 mt -78.29 -26.11 46.93 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 123.08 0.552 . . . . 60.31 111.035 179.23 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -72.06 -24.91 61.59 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.491 0.716 . . . . 73.42 111.966 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 20.9 mtm180 -59.31 -35.91 74.67 Favored 'General case' 0 N--CA 1.497 1.901 0 CA-C-O 121.29 0.567 . . . . 74.51 110.529 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.577 ' HB ' ' HB2' ' B' ' 74' ' ' LYS . 82.6 p -92.08 3.73 54.64 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-N 115.165 -0.925 . . . . 74.33 111.703 177.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.31 -112.94 2.94 Favored Glycine 0 CA--C 1.535 1.287 0 N-CA-C 115.806 1.082 . . . . 31.24 115.806 178.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.2 t60 -68.48 -28.32 66.92 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.01 0.924 . . . . 73.1 111.206 -176.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . 0.577 ' HB2' ' HB ' ' B' ' 71' ' ' THR . 12.0 mmmm -56.47 -57.99 9.94 Favored 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.393 0.677 . . . . 60.23 111.486 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.66 -37.46 94.4 Favored Glycine 0 CA--C 1.534 1.228 0 CA-C-N 115.933 -0.576 . . . . 75.03 113.369 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -50.31 -62.81 1.37 Allowed 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.998 0.919 . . . . 73.04 112.349 171.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' B' ' 80' ' ' LEU . 80.6 t -60.88 -40.86 86.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.111 0.565 . . . . 54.22 112.05 179.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.57 81.33 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 122.892 0.477 . . . . 73.2 112.175 177.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -71.59 -40.22 70.03 Favored 'General case' 0 CA--C 1.56 1.348 0 C-N-CA 123.083 0.553 . . . . 74.22 110.864 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' B' ' 77' ' ' VAL . 91.5 mt -54.95 -54.45 42.57 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.378 0.671 . . . . 64.53 112.6 173.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -70.34 -36.02 73.97 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.462 0.705 . . . . 75.12 112.052 -178.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 97.2 p -62.05 -49.62 75.24 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 117.788 0.267 . . . . 61.32 110.737 175.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.468 HD23 ' HB3' ' B' ' 90' ' ' LEU . 9.8 mp -60.14 -52.16 66.52 Favored 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 122.159 0.183 . . . . 62.3 111.344 174.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' B' ' 101' ' ' ARG . 25.1 tt0 -53.03 -30.05 33.37 Favored 'General case' 0 CA--C 1.567 1.615 0 C-N-CA 123.335 0.654 . . . . 71.33 112.134 -177.003 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 7.1 tt -77.82 -60.7 2.26 Favored 'General case' 0 CA--C 1.564 1.508 0 C-N-CA 124.011 0.924 . . . . 71.22 110.611 172.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . 0.505 ' HB3' HH11 ' B' ' 29' ' ' ARG . 84.9 m-85 -73.48 -64.88 0.9 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 123.867 0.867 . . . . 73.25 112.126 -175.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' HD23 ' B' ' 90' ' ' LEU . 89.2 m-85 -110.04 85.63 4.37 Favored Pre-proline 0 CA--C 1.565 1.551 0 C-N-CA 123.938 0.895 . . . . 64.1 111.707 179.161 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.16 -34.85 21.02 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.833 2.355 . . . . 74.21 112.815 -173.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -65.15 -31.17 72.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.734 0.814 . . . . 71.13 111.798 173.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.589 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -69.69 -39.73 76.77 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 122.384 0.274 . . . . 52.22 111.191 176.652 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.583 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 87.6 t80 -62.02 -47.04 86.51 Favored 'General case' 0 CA--C 1.558 1.278 0 CA-C-O 120.907 0.384 . . . . 74.4 110.555 170.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 49.6 mmtt -52.71 -41.75 64.22 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.321 1.048 . . . . 72.55 113.311 176.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.587 ' HD3' HD13 ' B' ' 90' ' ' LEU . 21.4 ptmt -82.48 -36.19 26.73 Favored 'General case' 0 N--CA 1.485 1.321 0 N-CA-C 113.335 0.865 . . . . 65.4 113.335 -179.163 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.403 HG23 HG23 ' B' ' 95' ' ' THR . 20.5 m -64.46 -37.4 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 CA-C-N 119.384 0.993 . . . . 54.4 112.309 174.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.403 HG23 HG23 ' B' ' 94' ' ' VAL . 71.9 p -92.49 -44.7 8.5 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.088 0.403 . . . . 55.34 112.088 -178.082 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 78.74 10.94 85.75 Favored Glycine 0 N--CA 1.48 1.588 0 N-CA-C 114.106 0.403 . . . . 15.41 114.106 -174.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.83 179.77 6.14 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.336 0.654 . . . . 73.23 111.266 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -55.32 148.26 32.93 Favored Pre-proline 0 CA--C 1.562 1.429 0 N-CA-C 113.44 0.904 . . . . 72.23 113.44 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.583 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 24.9 Cg_exo -63.89 110.58 1.34 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.521 2.147 . . . . 64.31 111.519 172.006 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.99 -29.14 63.92 Favored 'General case' 0 CA--C 1.55 0.967 0 CA-C-N 115.604 -0.726 . . . . 42.12 111.232 -174.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . 0.436 ' HA ' ' OE1' ' B' ' 84' ' ' GLU . 35.6 mmt180 76.13 46.18 0.1 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 125.683 1.593 . . . . 72.11 110.173 175.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 6.3 t -80.55 48.92 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 124.722 1.209 . . . . 70.14 112.646 -176.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.447 ' O ' HG12 ' B' ' 107' ' ' ILE . 80.8 m-85 -63.04 -2.0 1.12 Allowed 'General case' 0 CA--C 1.56 1.34 0 N-CA-C 113.041 0.756 . . . . 71.32 113.041 168.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 42.5 t -53.21 -30.15 36.16 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.577 1.151 . . . . 75.01 112.921 178.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . 0.461 ' HE1' ' HD2' ' B' ' 74' ' ' LYS . 39.3 tpp -59.07 -64.44 0.94 Allowed 'General case' 0 N--CA 1.479 1.012 0 N-CA-C 110.339 -0.245 . . . . 74.23 110.339 176.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 5.9 tt -65.42 -32.49 58.44 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.255 0 N-CA-C 112.406 0.521 . . . . 62.44 112.406 -177.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.447 HG12 ' O ' ' B' ' 103' ' ' PHE . 43.4 mm -62.22 -56.3 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.138 0 C-N-CA 122.548 0.339 . . . . 65.34 110.829 177.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -71.32 -18.05 62.42 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 113.035 0.754 . . . . 64.34 113.035 175.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.61 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.69 -63.28 1.45 Allowed 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.027 0.751 . . . . 65.31 113.027 179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 48.3 t -98.03 -39.19 9.05 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.713 0.805 . . . . 72.41 111.394 -177.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 129.18 156.54 8.92 Favored Glycine 0 C--O 1.244 0.723 0 CA-C-N 114.893 -1.048 . . . . 30.43 111.434 -170.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -58.31 -41.19 83.96 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.236 0.614 . . . . 51.55 111.424 175.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.7 p -65.29 -28.11 69.09 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.952 0.901 . . . . 54.41 111.99 178.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -62.46 -52.73 47.05 Favored Glycine 0 N--CA 1.482 1.728 0 CA-C-O 121.117 0.287 . . . . 73.1 112.577 173.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 50.3 tp -63.49 -35.31 80.02 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.126 0.57 . . . . 74.52 111.437 174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 77.4 m -58.21 -44.71 88.27 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 123.329 0.651 . . . . 73.05 110.567 174.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -67.0 -43.63 82.42 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.186 0.594 . . . . 72.04 111.829 177.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.453 HD11 ' HG3' ' B' ' 36' ' ' GLN . 68.9 mt -61.43 -39.88 92.41 Favored 'General case' 0 N--CA 1.494 1.75 0 CA-C-O 120.968 0.413 . . . . 60.3 111.89 177.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.645 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 62.9 mt -72.56 -32.26 65.9 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.714 0.806 . . . . 74.35 111.657 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -41.54 89.86 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.59 0.756 . . . . 74.41 110.8 178.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 9.0 t -75.29 -35.95 61.23 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 111.795 0.294 . . . . 70.51 111.795 172.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.1 tp10 -55.4 -42.99 74.79 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.229 0.612 . . . . 73.43 112.103 177.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . . . . . . . . . 19.8 m -66.34 -25.09 34.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.277 0 N-CA-C 111.884 0.328 . . . . 73.42 111.884 176.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.425 ' HB2' ' HE2' ' B' ' 124' ' ' MET . 40.0 mtm -81.5 -35.8 29.99 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.244 0.475 . . . . 65.32 110.287 179.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 28.2 mmmt -59.07 -51.16 71.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.201 1.0 . . . . 73.04 110.481 173.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 33.1 mt -63.35 -38.21 90.25 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 114.362 -1.29 . . . . 53.42 112.599 172.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -60.51 -37.47 81.25 Favored 'General case' 0 N--CA 1.497 1.894 0 C-N-CA 123.193 0.597 . . . . 62.14 111.417 175.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 61.2 mttp -73.36 -39.33 65.26 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.285 0.634 . . . . 74.31 111.056 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.461 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 55.0 tptt -63.67 -37.84 88.87 Favored 'General case' 0 CA--C 1.553 1.085 0 C-N-CA 123.305 0.642 . . . . 42.42 111.508 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.403 HG23 ' O ' ' B' ' 126' ' ' LEU . 55.3 t -67.58 -48.8 75.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 C-N-CA 123.354 0.662 . . . . 72.34 110.84 176.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.485 ' HA ' HG22 ' B' ' 134' ' ' THR . 7.8 pt20 -63.49 -31.17 72.26 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 110.652 -0.129 . . . . 70.51 110.652 178.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.491 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 29.0 t70 -64.92 -53.17 50.65 Favored 'General case' 0 C--N 1.353 0.749 0 C-N-CA 123.194 0.598 . . . . 72.22 109.812 178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 14.6 mt -68.03 -32.9 73.59 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-N 116.083 -0.508 . . . . 71.32 112.08 -177.337 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.485 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.7 t -75.62 -25.07 56.61 Favored 'General case' 0 N--CA 1.481 1.106 0 O-C-N 122.438 -0.163 . . . . 62.33 111.094 176.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -70.57 -41.63 72.14 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 122.943 0.497 . . . . 74.32 110.604 169.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.538 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -72.75 -22.35 60.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.513 0.725 . . . . 71.32 111.047 175.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.443 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -76.45 -41.8 46.09 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.093 0.557 . . . . 72.41 109.683 171.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 41.6 t -68.01 -26.1 65.73 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.122 0.569 . . . . 74.12 111.914 177.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 32.9 t -154.9 102.14 2.33 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.539 0.736 . . . . 70.11 110.094 177.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 61.5 tttm -105.24 -72.89 0.7 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.386 1.075 . . . . 71.24 110.647 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -115.66 9.63 15.31 Favored 'General case' 0 CA--C 1.558 1.26 0 C-N-CA 124.423 1.089 . . . . 51.42 109.941 172.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 20.6 t70 . . . . . 0 CA--C 1.562 1.438 0 C-N-CA 124.747 1.219 . . . . 72.2 108.905 -173.705 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.143 0 CA-C-O 120.441 -0.088 . . . . 74.14 112.954 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.0 m -88.26 107.83 19.0 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.168 0.587 . . . . 73.52 110.948 179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -91.95 139.32 30.76 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.307 0.643 . . . . 72.41 111.048 174.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -69.85 -33.28 72.06 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 123.281 0.632 . . . . 63.31 110.95 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -119.96 121.81 39.8 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 123.887 0.875 . . . . 54.42 111.074 -173.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -77.97 155.84 30.56 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.155 0.582 . . . . 72.04 110.155 167.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.433 ' O ' ' SG ' ' A' ' 10' ' ' CYS . 3.6 p-10 -85.94 74.3 10.17 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-O 122.958 1.361 . . . . 73.33 110.531 -179.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.492 ' HB2' ' HG2' ' A' ' 69' ' ' GLN . 6.1 p-10 -80.03 -12.64 59.68 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-N 115.178 -0.919 . . . . 74.54 111.412 173.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.8 -19.81 64.31 Favored 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.69 0.796 . . . . 64.43 112.061 175.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.433 ' SG ' ' O ' ' A' ' 7' ' ' ASP . 28.0 p -59.72 -27.16 66.22 Favored 'General case' 0 N--CA 1.497 1.907 0 C-N-CA 122.834 0.453 . . . . 71.05 111.822 174.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.502 ' HZ3' HD22 ' A' ' 65' ' ' LEU . 51.9 m95 -52.92 -17.39 1.39 Allowed 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 114.705 1.372 . . . . 75.1 114.705 169.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.47 ' HA ' ' HB3' ' A' ' 15' ' ' GLU . 94.3 p -57.66 -31.02 65.9 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.277 0.631 . . . . 63.21 112.2 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 60.9 t -60.47 -42.78 92.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 124.136 0.974 . . . . 74.31 111.374 175.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.4 mt -78.53 -35.52 46.07 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-N 115.731 -0.668 . . . . 72.25 110.812 175.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 18' ' ' ARG . 40.8 tt0 -63.71 -37.56 87.8 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.751 1.22 . . . . 72.43 112.246 -175.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.95 -18.81 41.9 Favored Glycine 0 CA--C 1.534 1.27 0 N-CA-C 113.92 0.328 . . . . 74.12 113.92 174.117 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.424 ' HB2' HG12 ' A' ' 94' ' ' VAL . 62.4 m-85 -125.92 21.38 7.56 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.373 0.669 . . . . 71.22 110.686 176.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.546 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.5 ptt180 -64.68 -32.21 73.78 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 111.911 0.337 . . . . 61.45 111.911 -175.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.2 p -61.61 -33.11 55.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 122.916 0.486 . . . . 64.01 110.94 176.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.474 HG21 ' HE2' ' A' ' 93' ' ' LYS . 12.3 m -78.61 -44.62 23.52 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 123.224 0.61 . . . . 51.5 110.367 177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.506 HD23 HD12 ' A' ' 90' ' ' LEU . 89.6 mt -57.2 -39.17 74.88 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.149 0.579 . . . . 63.34 111.716 176.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.725 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 72.9 p -81.0 -20.63 41.4 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.778 0.831 . . . . 74.21 112.968 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 81.2 p -91.0 -22.08 20.97 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 113.126 0.787 . . . . 71.13 113.126 175.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.513 HG11 HD21 ' A' ' 90' ' ' LEU . 76.8 t -96.75 -59.04 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 N-CA-C 112.739 0.644 . . . . 73.13 112.739 179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 20.1 mt -76.86 152.72 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 123.458 0.703 . . . . 73.41 111.893 -168.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -124.77 122.39 25.65 Favored Pre-proline 0 C--O 1.249 1.027 0 N-CA-C 108.637 -0.875 . . . . 72.35 108.637 169.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.483 ' HD2' ' HE2' ' A' ' 60' ' ' LYS . 99.5 Cg_exo -47.59 -36.66 25.27 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 123.42 2.747 . . . . 65.41 114.485 -175.106 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 92.3 p -61.69 -24.31 66.68 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 112.951 0.723 . . . . 62.52 112.951 -173.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -83.33 -31.48 26.79 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 117.727 0.24 . . . . 75.22 111.023 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 25.9 pt -98.31 -13.14 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 C-N-CA 123.132 0.573 . . . . 72.12 112.516 -177.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.525 HG22 HD11 ' A' ' 40' ' ' LEU . 13.5 p -57.67 -40.67 85.7 Favored Pre-proline 0 N--CA 1.496 1.873 0 CA-C-O 117.676 -1.154 . . . . 51.3 113.499 178.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 31' ' ' THR . 19.6 Cg_endo -58.34 -41.36 66.89 Favored 'Trans proline' 0 C--N 1.399 3.198 0 CA-C-N 121.902 1.715 . . . . 64.4 113.488 175.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -68.42 -47.13 68.05 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.874 0.47 . . . . 71.14 111.318 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.8 mt -60.15 -34.68 73.89 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 122.99 0.516 . . . . 74.13 112.337 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 22.3 mmm-85 -61.48 -51.67 67.69 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.488 0.715 . . . . 64.22 111.698 171.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -72.1 -18.0 61.94 Favored 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 122.793 0.437 . . . . 72.24 112.055 -179.515 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 74.7 m -78.48 -13.62 59.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.836 0.854 . . . . 74.01 110.861 169.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.634 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 33.2 mmtp 72.21 13.34 5.73 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.534 1.534 . . . . 73.31 112.144 174.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 33.2 m -90.9 -29.85 4.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.736 0.814 . . . . 63.51 111.649 179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD11 HG22 ' A' ' 31' ' ' THR . 9.0 tt -99.84 127.83 45.97 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.947 0.899 . . . . 75.12 109.612 178.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.3 m-80 -92.71 152.89 42.2 Favored Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 123.482 0.713 . . . . 72.34 110.216 176.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.83 -15.04 15.42 Favored 'Trans proline' 0 C--N 1.381 2.276 0 C-N-CA 122.921 2.414 . . . . 54.23 114.308 179.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -74.17 -43.32 57.77 Favored 'General case' 0 C--O 1.257 1.448 0 C-N-CA 123.825 0.85 . . . . 73.22 111.333 174.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.605 ' HA ' HE21 ' A' ' 47' ' ' GLN . 48.7 m-20 -61.78 -60.12 4.13 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-N 115.156 -0.929 . . . . 74.43 112.043 -174.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -44.98 -36.92 3.65 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 113.403 0.89 . . . . 71.35 113.403 174.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -72.8 -45.79 56.63 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.745 0.418 . . . . 70.5 111.875 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.686 HE22 HD11 ' A' ' 67' ' ' ILE . 4.6 pp0? -78.84 -26.68 44.15 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 113.34 0.867 . . . . 74.1 113.34 -178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 96.5 t -74.84 -53.38 16.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 C-N-CA 123.664 0.786 . . . . 74.12 110.226 174.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.11 64.6 8.78 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-O 122.081 0.943 . . . . 71.54 109.226 173.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 35.9 t -120.38 8.67 10.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 125.007 1.323 . . . . 53.0 109.856 179.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -76.13 140.23 69.57 Favored Pre-proline 0 CA--C 1.561 1.383 0 C-N-CA 124.981 1.313 . . . . 73.24 111.833 -177.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -86.56 9.22 4.09 Favored 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.98 2.453 . . . . 74.43 113.623 177.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 175.91 165.52 0.38 Allowed 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.487 1.115 . . . . 71.45 108.345 -169.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 26.3 mt -95.39 37.06 1.2 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.528 0.731 . . . . 73.21 112.017 -173.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 35.9 t -92.13 -43.46 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 C-N-CA 123.4 0.68 . . . . 63.23 111.05 -177.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 35.1 pt -90.13 27.45 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 N-CA-C 113.224 0.824 . . . . 71.23 113.224 -176.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 60' ' ' LYS . 33.9 mtm180 -55.61 -23.17 25.94 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 112.487 0.551 . . . . 71.4 112.487 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.725 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 41.8 mmtm -54.2 -54.89 33.74 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.605 0.762 . . . . 65.41 111.513 167.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -60.03 -43.96 94.96 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.748 0.819 . . . . 74.31 111.385 177.868 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.538 ' HD3' ' HA ' ' A' ' 57' ' ' ARG . 54.3 mtpt -59.48 -58.75 7.22 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.143 0.977 . . . . 55.22 112.655 -174.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.486 ' O ' ' HG ' ' A' ' 65' ' ' LEU . 25.8 t -67.99 -35.96 73.81 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.185 0.194 . . . . 52.03 110.495 178.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -59.28 -48.85 83.96 Favored Glycine 0 C--N 1.351 1.395 0 O-C-N 123.657 0.598 . . . . 34.04 114.32 -178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 33.5 m -68.31 -33.31 59.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 CA-C-N 116.831 0.316 . . . . 73.12 110.99 176.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 27' ' ' PRO . 48.9 tp -65.19 -38.58 90.93 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.471 0.708 . . . . 75.04 111.71 178.134 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.502 HD22 ' HZ3' ' A' ' 11' ' ' TRP . 88.1 mt -56.47 -43.32 79.48 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.938 0.495 . . . . 74.53 110.401 176.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -69.52 -35.04 75.12 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.167 0.987 . . . . 72.51 112.213 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.686 HD11 HE22 ' A' ' 47' ' ' GLN . 92.9 mt -62.24 -39.41 83.97 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.932 0 C-N-CA 123.775 0.83 . . . . 74.32 111.286 173.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 55.0 mt -83.74 -21.96 32.1 Favored 'General case' 0 CA--C 1.564 1.509 0 CA-C-N 115.619 -0.718 . . . . 74.43 111.411 177.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.492 ' HG2' ' HB2' ' A' ' 8' ' ' ASP . 41.4 tt0 -77.77 -34.77 52.17 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 123.227 0.611 . . . . 74.21 111.954 178.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.444 ' HG2' ' O ' ' A' ' 67' ' ' ILE . 25.5 ptt180 -66.23 -16.19 63.8 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 123.202 0.601 . . . . 71.25 111.703 179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.466 ' HB ' ' HE2' ' A' ' 74' ' ' LYS . 42.7 p -94.08 14.9 18.46 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 123.382 0.673 . . . . 34.32 110.61 175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 67.69 -123.76 19.88 Favored Glycine 0 C--N 1.351 1.38 0 C-N-CA 123.455 0.55 . . . . 74.52 114.241 179.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 12.7 t60 -84.32 -15.34 46.92 Favored 'General case' 0 CA--C 1.555 1.167 0 C-N-CA 123.873 0.869 . . . . 75.22 111.571 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.466 ' HE2' ' HB ' ' A' ' 71' ' ' THR . 37.4 ttpt -65.0 -57.01 9.8 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.627 0.771 . . . . 73.31 111.788 -176.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.45 -26.45 74.31 Favored Glycine 0 C--N 1.345 1.058 0 CA-C-N 115.478 -0.783 . . . . 61.24 113.339 175.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -55.39 -57.61 11.16 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.055 0.542 . . . . 63.03 110.751 169.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.61 ' HA ' HD12 ' A' ' 80' ' ' LEU . 73.7 t -57.4 -43.79 83.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 123.773 0.829 . . . . 52.11 111.169 177.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -59.02 -42.09 89.31 Favored 'General case' 0 CA--C 1.557 1.245 0 N-CA-C 113.166 0.802 . . . . 75.13 113.166 178.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -66.55 -40.76 89.2 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 122.293 0.237 . . . . 72.43 110.809 175.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.61 HD12 ' HA ' ' A' ' 77' ' ' VAL . 34.7 mt -62.21 -36.46 82.01 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.336 0.654 . . . . 61.01 112.278 177.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.403 ' OE2' ' HA ' ' A' ' 103' ' ' PHE . 60.8 mt-10 -62.77 -53.11 59.31 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 124.192 0.997 . . . . 72.11 110.851 171.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 66.0 m -61.24 -30.41 70.43 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-N 114.65 -1.159 . . . . 71.42 110.851 179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 tp -84.9 -34.56 22.52 Favored 'General case' 0 CA--C 1.549 0.912 0 O-C-N 122.041 -0.412 . . . . 75.23 111.799 179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 99' ' ' PRO . 77.9 tt0 -61.56 -32.9 73.0 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 121.473 0.654 . . . . 74.2 110.403 178.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.527 ' HB2' ' HZ ' ' A' ' 103' ' ' PHE . 7.1 tt -86.55 -63.91 1.24 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.304 -0.862 . . . . 73.32 111.097 176.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -72.62 -38.85 67.65 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 112.874 0.694 . . . . 74.13 112.874 -165.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.549 ' HB3' HD23 ' A' ' 90' ' ' LEU . 86.0 m-85 -138.86 73.85 39.01 Favored Pre-proline 0 N--CA 1.482 1.173 0 CA-C-N 117.945 0.338 . . . . 71.13 111.316 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -62.6 -21.23 72.66 Favored 'Trans proline' 0 C--N 1.381 2.288 0 C-N-CA 122.96 2.44 . . . . 73.31 113.017 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -70.54 -44.06 68.27 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 123.552 0.741 . . . . 71.11 111.557 170.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' A' ' 87' ' ' TYR . 3.8 mm? -63.53 -32.23 73.63 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.935 0.494 . . . . 71.42 110.225 171.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -72.04 -39.43 69.11 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.177 0.591 . . . . 73.1 110.45 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.614 ' HE3' ' HG3' ' A' ' 98' ' ' GLU . 4.8 tppp? -58.27 -45.05 88.6 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.169 0.988 . . . . 71.32 111.609 173.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.505 ' HD3' HD13 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -72.15 -42.9 65.44 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 112.868 0.692 . . . . 75.32 112.868 -179.356 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.639 HG23 HG23 ' A' ' 95' ' ' THR . 33.8 m -70.8 -49.26 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 113.868 1.062 . . . . 74.02 113.868 179.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.639 HG23 HG23 ' A' ' 94' ' ' VAL . 48.0 p -96.48 -42.75 7.94 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 112.419 0.526 . . . . 62.14 112.419 -175.09 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 124.99 -8.57 8.05 Favored Glycine 0 N--CA 1.482 1.721 0 CA-C-N 116.977 -0.101 . . . . 42.33 113.334 -178.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -141.5 146.3 36.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.746 0.818 . . . . 71.11 110.76 -178.401 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.614 ' HG3' ' HE3' ' A' ' 92' ' ' LYS . 44.5 mt-10 -71.54 -50.8 10.12 Favored Pre-proline 0 CA--C 1.569 1.704 0 CA-C-O 119.069 -0.491 . . . . 74.21 112.238 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.419 ' HA ' ' HG3' ' A' ' 84' ' ' GLU . 28.6 Cg_endo -97.18 167.05 0.91 Allowed 'Trans proline' 0 C--N 1.389 2.68 0 C-N-CA 122.636 2.224 . . . . 62.32 112.301 167.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -164.87 7.93 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 114.455 1.28 . . . . 62.45 114.455 -178.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 57.61 58.47 3.73 Favored 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.075 0.852 . . . . 71.13 112.874 177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 21.8 t -104.77 -15.71 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 CA-C-N 116.009 -0.541 . . . . 74.43 111.919 -169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.527 ' HZ ' ' HB2' ' A' ' 85' ' ' LEU . 37.6 m-85 -68.28 4.4 1.31 Allowed 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 115.553 1.686 . . . . 74.41 115.553 -166.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 46.8 t -59.82 -26.0 65.42 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 114.026 1.121 . . . . 62.55 114.026 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 37.8 tpp -65.76 -59.43 3.9 Favored 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 118.035 0.38 . . . . 63.44 110.988 176.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -65.65 -29.23 46.38 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.495 0 C-N-CA 123.987 0.915 . . . . 63.32 110.738 -178.818 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.459 HD12 ' HG2' ' A' ' 112' ' ' GLU . 36.7 mm -63.41 -57.24 12.74 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.383 0 O-C-N 121.864 -0.523 . . . . 74.15 111.029 170.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -62.89 -26.14 68.64 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 112.837 0.681 . . . . 70.11 112.837 178.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.634 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -89.37 -43.83 10.63 Favored 'General case' 0 N--CA 1.485 1.324 0 N-CA-C 113.451 0.908 . . . . 75.42 113.451 -176.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.9 t -119.75 -2.41 10.4 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 113.636 0.976 . . . . 33.21 113.636 -172.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.34 160.22 33.92 Favored Glycine 0 CA--C 1.535 1.322 0 CA-C-O 120.83 0.128 . . . . 70.43 113.373 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.459 ' HG2' HD12 ' A' ' 107' ' ' ILE . 45.3 mt-10 -64.82 -42.5 94.92 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.028 0.531 . . . . 75.44 111.891 177.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.9 p -65.21 -30.83 71.76 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.456 0.702 . . . . 73.22 111.369 175.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.15 -54.37 38.1 Favored Glycine 0 C--N 1.353 1.498 0 CA-C-N 116.708 -0.224 . . . . 62.22 112.66 172.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 46.1 tp -64.06 -35.45 80.77 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.798 0.439 . . . . 73.44 111.68 175.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 90.9 m -58.59 -45.72 88.49 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.017 0.527 . . . . 73.24 110.764 176.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.69 -39.14 77.13 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.259 0.624 . . . . 74.11 111.913 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 53.7 mt -59.54 -49.19 78.74 Favored 'General case' 0 N--CA 1.498 1.964 0 CA-C-O 121.371 0.605 . . . . 61.11 111.715 174.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 76.8 mt -61.84 -42.08 98.61 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.183 0.993 . . . . 61.44 111.263 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.548 ' HE1' ' HA ' ' B' ' 85' ' ' LEU . 9.2 tpt -62.38 -40.2 95.68 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.989 0.915 . . . . 72.11 111.806 -178.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 13.6 t -75.24 -35.97 61.35 Favored 'General case' 0 N--CA 1.484 1.232 0 O-C-N 121.602 -0.686 . . . . 70.43 111.711 173.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -64.27 -34.36 77.94 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 112.585 0.587 . . . . 72.15 112.585 -177.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 119' ' ' LEU . 15.0 m -62.98 -25.93 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 CA-C-N 118.005 0.366 . . . . 74.53 111.237 174.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.452 ' O ' ' HG2' ' A' ' 128' ' ' LYS . 56.0 mtm -79.27 -40.1 31.36 Favored 'General case' 0 C--N 1.357 0.919 0 N-CA-C 110.082 -0.34 . . . . 64.33 110.082 178.144 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 125' ' ' LYS . 11.0 mmpt? -57.78 -35.44 70.8 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 123.533 0.733 . . . . 73.22 111.176 172.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 22.3 mt -72.42 -43.21 64.18 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 114.833 -1.076 . . . . 73.25 111.629 176.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . . . . . . . . . 28.9 tt0 -66.66 -26.19 66.93 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 120.81 0.338 . . . . 73.23 111.514 176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . 0.458 ' O ' ' HG2' ' A' ' 131' ' ' GLN . 73.8 mmtt -73.65 -46.07 48.93 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 109.42 -0.585 . . . . 44.41 109.42 172.601 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.494 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 53.0 tptt -56.52 -41.87 77.47 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.254 0.621 . . . . 73.31 111.458 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 40.4 t -61.57 -48.45 88.7 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 C-N-CA 124.304 1.042 . . . . 62.11 110.434 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.597 ' HA ' HG22 ' A' ' 134' ' ' THR . 7.9 pt20 -69.0 -29.45 67.65 Favored 'General case' 0 CA--C 1.561 1.384 0 O-C-N 122.434 -0.166 . . . . 73.41 111.284 -178.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -65.63 -34.48 78.33 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.304 0.641 . . . . 54.32 110.935 176.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 22.2 mt -81.73 -45.1 16.14 Favored 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 116.061 -0.518 . . . . 75.35 110.58 -177.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.597 HG22 ' HA ' ' A' ' 131' ' ' GLN . 6.6 t -64.89 -25.71 68.01 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 122.283 0.233 . . . . 74.54 111.349 177.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -60.8 -56.49 20.61 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 122.987 0.515 . . . . 42.54 111.24 171.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.641 ' HB2' HD11 ' B' ' 137' ' ' LEU . 21.8 mt -73.05 -20.81 60.9 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.125 0.57 . . . . 63.34 111.546 -178.45 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.61 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.1 tt -72.0 -55.16 7.9 Favored 'General case' 0 CA--C 1.554 1.124 0 N-CA-C 108.722 -0.844 . . . . 45.45 108.722 175.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 46.8 t -54.74 -40.09 68.93 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.74 1.216 . . . . 61.13 112.927 -179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 62.2 m -133.05 103.36 6.0 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.379 0.672 . . . . 74.34 109.899 -179.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -88.94 163.46 15.57 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.611 0.765 . . . . 71.41 112.597 176.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 59.81 20.49 9.34 Favored 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 124.588 1.155 . . . . 62.43 112.867 -176.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.574 1.871 0 C-N-CA 124.448 1.099 . . . . 73.44 112.591 -178.537 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.426 0 N-CA-C 114.182 0.433 . . . . 64.41 114.182 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 33.7 t -152.04 30.85 0.56 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.909 0.883 . . . . 74.14 110.002 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -67.88 105.62 2.04 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.772 0.829 . . . . 72.11 111.225 -174.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -76.97 -52.66 9.0 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.898 0.879 . . . . 75.11 111.049 -178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -87.03 112.57 21.99 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.791 0.836 . . . . 72.3 111.45 -175.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.531 ' HB3' ' H ' ' B' ' 73' ' ' HIS . 86.8 m-20 -69.63 128.11 35.32 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.998 -0.742 . . . . 64.42 108.998 168.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -75.53 118.75 18.73 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 122.091 0.948 . . . . 63.54 112.806 -171.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -77.97 -10.24 59.49 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 115.665 -0.698 . . . . 72.04 110.913 165.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -50.52 -40.8 52.59 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.691 1.197 . . . . 73.53 113.367 176.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 43.2 m -54.14 -29.15 44.18 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 113.366 0.876 . . . . 72.12 113.366 178.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 73.9 m95 -59.02 -19.29 42.41 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 114.181 1.178 . . . . 73.23 114.181 176.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 41.2 t -60.57 -28.64 68.61 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.25 0.62 . . . . 63.52 111.836 -179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 64.2 t -63.47 -42.7 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 124.039 0.936 . . . . 75.23 111.173 173.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 57.6 mt -78.83 -30.14 45.12 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.548 0.739 . . . . 75.22 111.084 178.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.605 ' HA ' ' HB3' ' B' ' 18' ' ' ARG . 35.8 tt0 -64.68 -33.18 75.33 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.878 0.871 . . . . 75.44 111.508 -177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -58.76 -18.45 39.03 Favored Glycine 0 CA--C 1.538 1.503 0 N-CA-C 114.112 0.405 . . . . 65.25 114.112 173.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.504 ' HB2' HG12 ' B' ' 94' ' ' VAL . 71.6 m-85 -125.99 17.3 7.9 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.489 0.716 . . . . 74.53 111.136 175.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.605 ' HB3' ' HA ' ' B' ' 15' ' ' GLU . 31.3 ptt180 -63.17 -30.09 71.31 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 119.198 -0.43 . . . . 61.41 111.494 -174.773 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.6 p -62.81 -33.17 58.74 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 122.89 0.476 . . . . 75.42 111.278 178.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 12.3 m -76.39 -48.29 20.32 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.097 0.559 . . . . 50.45 110.364 174.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' B' ' 83' ' ' LEU . 60.7 mt -58.49 -40.43 82.76 Favored 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 123.077 0.551 . . . . 75.42 111.937 -179.003 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.693 HG22 ' HB ' ' B' ' 61' ' ' VAL . 43.2 p -72.12 -26.7 62.23 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.879 0.871 . . . . 74.33 112.693 177.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 26.3 t -83.21 -35.66 25.24 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 123.258 0.623 . . . . 62.53 112.673 179.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.487 HG11 HD21 ' B' ' 90' ' ' LEU . 65.4 t -96.55 -51.66 10.3 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 C-N-CA 123.393 0.677 . . . . 51.11 112.165 -174.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 53.7 mt -81.44 140.29 16.76 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.532 0.733 . . . . 71.23 110.804 -172.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.574 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 6.6 t70 -123.14 108.5 32.13 Favored Pre-proline 0 CA--C 1.554 1.12 0 N-CA-C 109.834 -0.432 . . . . 71.51 109.834 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.597 ' HG2' ' HG2' ' B' ' 60' ' ' LYS . 1.3 Cg_exo -34.13 -35.78 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 125.258 3.972 . . . . 75.24 116.977 178.017 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 76.2 p -66.01 -22.04 66.43 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-N 119.14 0.882 . . . . 60.45 112.9 -173.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 4.0 ptp180 -92.5 -15.58 26.87 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.221 0.452 . . . . 72.33 112.221 177.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 29.3 pt -109.85 -8.0 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 122.039 -0.413 . . . . 71.22 111.999 177.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.517 HG22 HD11 ' B' ' 40' ' ' LEU . 7.7 p -60.1 -45.17 97.9 Favored Pre-proline 0 N--CA 1.495 1.794 0 CA-C-O 117.87 -1.062 . . . . 74.42 112.816 176.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.492 ' O ' ' HG2' ' B' ' 36' ' ' GLN . 44.0 Cg_endo -64.06 -32.32 64.48 Favored 'Trans proline' 0 C--N 1.401 3.291 0 CA-C-N 121.604 1.609 . . . . 72.33 112.081 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.18 -50.89 51.42 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.53 0.732 . . . . 74.21 110.816 177.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 90.8 mt -61.0 -29.1 69.5 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 123.796 0.839 . . . . 71.5 112.103 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -62.06 -49.49 75.75 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.276 0.631 . . . . 61.54 111.282 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.568 ' HG3' HD21 ' B' ' 118' ' ' LEU . 16.8 mm100 -64.46 -28.47 69.69 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.267 0.627 . . . . 70.3 111.785 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -76.7 -13.92 60.0 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.659 0.784 . . . . 60.21 111.612 172.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.565 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 33.2 mmtp 75.89 9.87 3.35 Favored 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 125.572 1.549 . . . . 61.23 112.586 172.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 28.0 m -89.71 -32.98 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.411 0.684 . . . . 74.21 111.637 -177.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.517 HD11 HG22 ' B' ' 31' ' ' THR . 10.2 tt -93.38 129.39 39.53 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.787 0.835 . . . . 71.24 110.495 -179.644 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -90.96 156.38 44.34 Favored Pre-proline 0 N--CA 1.48 1.051 0 C-N-CA 124.825 1.25 . . . . 70.21 111.421 176.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -54.72 -20.83 23.13 Favored 'Trans proline' 0 C--N 1.383 2.363 0 C-N-CA 123.19 2.593 . . . . 51.55 114.165 176.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -74.2 -41.34 61.57 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.676 0.79 . . . . 75.15 112.198 176.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.701 ' HA ' HE21 ' B' ' 47' ' ' GLN . 31.1 m-20 -65.32 -47.61 75.94 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.616 0.767 . . . . 54.02 111.768 -173.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.477 ' HB3' HD21 ' B' ' 40' ' ' LEU . 10.5 pt-20 -60.24 -21.89 62.38 Favored 'General case' 0 N--CA 1.486 1.336 0 CA-C-N 115.75 -0.659 . . . . 70.22 112.37 177.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -80.76 -62.69 1.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.588 0.355 . . . . 73.52 111.679 173.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.701 HE21 ' HA ' ' B' ' 44' ' ' ASP . 4.5 pp0? -73.31 -29.91 63.02 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 113.75 1.018 . . . . 75.33 113.75 -168.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.456 HG22 HG23 ' B' ' 63' ' ' VAL . 39.3 t -62.49 -41.07 90.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.2 0.6 . . . . 70.14 111.01 174.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.33 57.14 3.84 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.942 0.897 . . . . 70.42 111.513 -178.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 40.8 t -68.28 -34.37 76.05 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.897 0.879 . . . . 73.21 112.761 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -52.32 123.07 27.23 Favored Pre-proline 0 CA--C 1.562 1.406 0 N-CA-C 114.023 1.12 . . . . 71.51 114.023 173.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -67.94 -75.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.564 2.007 0 C-N-CA 121.914 1.743 . . . . 74.43 109.719 156.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 12.6 t-20 -94.61 179.51 5.24 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.807 -0.812 . . . . 61.14 108.807 161.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.446 HD13 ' NH1' ' B' ' 57' ' ' ARG . 34.0 mt -93.35 72.28 4.48 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.163 -0.961 . . . . 71.35 112.12 -165.714 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 39.7 t -98.68 -44.24 12.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 C-N-CA 123.472 0.709 . . . . 75.11 111.288 177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 29.6 pt -107.42 27.23 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 124.628 1.171 . . . . 64.42 111.94 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.446 ' NH1' HD13 ' B' ' 54' ' ' LEU . 12.3 ptm180 -58.14 -24.95 60.73 Favored 'General case' 0 N--CA 1.499 1.999 0 N-CA-C 113.376 0.88 . . . . 63.2 113.376 -176.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.585 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 44.6 mmtm -60.84 -39.22 88.25 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.327 0.584 . . . . 72.25 110.74 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -68.89 -46.58 68.04 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.873 1.269 . . . . 50.24 109.505 178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.597 ' HG2' ' HG2' ' B' ' 27' ' ' PRO . 38.4 ttmt -51.82 -63.67 1.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.927 1.291 . . . . 73.44 112.469 177.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.693 ' HB ' HG22 ' B' ' 22' ' ' THR . 8.4 t -66.36 -34.19 68.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 122.397 0.279 . . . . 64.31 110.594 -178.164 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -62.82 -40.21 98.95 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.68 -0.691 . . . . 73.31 113.773 -178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.456 HG23 HG22 ' B' ' 48' ' ' VAL . 27.4 m -76.62 -30.01 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.131 0 CA-C-O 119.199 -0.429 . . . . 74.11 112.099 174.461 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . 0.42 HD22 ' HG3' ' B' ' 27' ' ' PRO . 39.4 tp -59.03 -36.69 75.41 Favored 'General case' 0 N--CA 1.493 1.69 0 CA-C-N 118.443 0.565 . . . . 71.32 111.048 172.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 66.2 mt -53.12 -50.09 65.2 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-N 115.9 -0.591 . . . . 54.2 109.609 173.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -62.3 -39.68 93.79 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 124.101 0.961 . . . . 72.41 112.331 179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.414 HD11 HE22 ' B' ' 47' ' ' GLN . 1.6 mp -60.21 -42.21 89.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 124.092 0.957 . . . . 64.02 111.58 176.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 78.9 mt -84.32 -19.11 34.27 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-N 115.75 -0.659 . . . . 60.31 112.082 177.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 81.9 mt-30 -78.93 -31.12 45.07 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 123.656 0.783 . . . . 73.42 112.374 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 ptt180 -68.43 -20.58 64.65 Favored 'General case' 0 N--CA 1.496 1.839 0 CA-C-N 118.224 0.466 . . . . 74.51 111.629 173.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 34.1 p -92.28 9.9 31.96 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 122.935 0.494 . . . . 74.33 109.942 171.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 59.73 -123.7 34.03 Favored Glycine 0 C--N 1.354 1.55 0 N-CA-C 116.144 1.218 . . . . 31.24 116.144 176.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . 0.531 ' H ' ' HB3' ' B' ' 6' ' ' ASN . 7.0 t60 -80.16 -17.65 51.89 Favored 'General case' 0 CA--C 1.555 1.145 0 C-N-CA 123.953 0.901 . . . . 73.1 109.994 -177.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -69.3 -51.07 40.82 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 123.22 0.608 . . . . 60.23 111.559 -179.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.15 -25.0 73.48 Favored Glycine 0 C--N 1.35 1.322 0 CA-C-N 115.898 -0.592 . . . . 75.03 113.14 172.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.449 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 83.0 t80 -60.86 -50.69 72.42 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.144 0.578 . . . . 73.04 111.053 168.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 73' ' ' HIS . 75.8 t -57.13 -49.83 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.792 0.837 . . . . 54.22 110.164 176.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -61.11 -38.88 87.91 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.349 -0.841 . . . . 73.2 112.985 -179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -67.13 -40.95 86.89 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 122.865 0.466 . . . . 74.22 110.894 175.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.512 ' HB2' HG11 ' B' ' 102' ' ' VAL . 94.7 mt -57.26 -46.42 83.08 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.741 0.416 . . . . 64.53 110.52 174.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.88 -52.15 66.69 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.954 0.902 . . . . 75.12 112.116 176.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 59.8 m -60.01 -47.18 86.89 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 123.443 0.697 . . . . 61.32 111.422 -178.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.508 HD11 HD22 ' B' ' 21' ' ' LEU . 8.3 tt -73.18 -31.59 64.3 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.677 -1.147 . . . . 62.3 110.717 -178.314 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 74.2 tt0 -69.44 -46.87 65.72 Favored 'General case' 0 N--CA 1.492 1.641 0 CA-C-O 121.257 0.551 . . . . 71.33 110.119 178.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.548 ' HA ' ' HE1' ' A' ' 120' ' ' MET . 6.8 tt -63.93 -64.32 0.92 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.024 -0.989 . . . . 71.22 110.394 179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -82.86 -15.85 49.9 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.286 0.847 . . . . 73.25 113.286 -168.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' B' ' 90' ' ' LEU . 90.9 m-85 -144.69 62.76 9.88 Favored Pre-proline 0 N--CA 1.494 1.76 0 N-CA-C 112.411 0.523 . . . . 64.1 112.411 -177.624 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_endo -58.49 -26.36 77.9 Favored 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.704 2.269 . . . . 74.21 113.946 -177.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -77.44 -35.62 53.84 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.317 0.647 . . . . 71.13 112.147 177.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.487 HD21 HG11 ' B' ' 24' ' ' VAL . 4.1 mm? -66.69 -33.17 75.05 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.993 -0.442 . . . . 52.22 110.095 171.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.47 ' HA ' HG22 ' B' ' 94' ' ' VAL . 6.5 t80 -70.86 -38.9 73.15 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.17 0.588 . . . . 74.4 110.081 175.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . 0.575 ' HB2' ' HG3' ' B' ' 98' ' ' GLU . 29.0 tptp -55.86 -46.72 78.16 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.364 1.066 . . . . 72.55 111.375 174.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.41 ' HE3' ' HB2' ' B' ' 93' ' ' LYS . 20.1 ptmt -74.58 -40.63 61.51 Favored 'General case' 0 CA--C 1.562 1.422 0 N-CA-C 113.702 1.001 . . . . 65.4 113.702 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.615 HG23 HG23 ' B' ' 95' ' ' THR . 32.5 m -69.02 -52.65 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 N-CA-C 113.837 1.051 . . . . 54.4 113.837 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.615 HG23 HG23 ' B' ' 94' ' ' VAL . 43.0 p -89.61 -36.46 15.28 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 112.316 0.488 . . . . 55.34 112.316 -176.312 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 120.8 -17.43 9.36 Favored Glycine 0 N--CA 1.475 1.246 0 N-CA-C 112.082 -0.407 . . . . 15.41 112.082 -175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.67 157.87 44.81 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.387 0.675 . . . . 73.23 111.904 -177.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.575 ' HG3' ' HB2' ' B' ' 92' ' ' LYS . 25.6 mp0 -80.93 -53.54 0.79 Allowed Pre-proline 0 CA--C 1.566 1.588 0 CA-C-N 115.447 -0.797 . . . . 72.23 111.963 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -84.3 147.83 11.49 Favored 'Trans proline' 0 C--N 1.398 3.153 0 C-N-CA 121.887 1.724 . . . . 64.31 112.449 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . 0.406 ' HB2' ' HE2' ' B' ' 91' ' ' TYR . . . -153.38 -15.0 0.15 Allowed 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 114.046 1.128 . . . . 42.12 114.046 -177.378 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 48.4 mtp180 55.13 62.3 2.55 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 113.374 0.879 . . . . 72.11 113.374 -178.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.512 HG11 ' HB2' ' B' ' 80' ' ' LEU . 46.4 t -104.28 -6.65 9.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 CA-C-N 115.721 -0.672 . . . . 70.14 110.134 -175.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.42 ' O ' HG12 ' B' ' 107' ' ' ILE . 94.1 m-85 -66.18 0.83 1.78 Allowed 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 114.626 1.343 . . . . 71.32 114.626 -169.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 46.5 t -51.23 -39.39 56.5 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 124.863 1.265 . . . . 75.01 113.714 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 44.7 tpp -61.57 -58.97 6.0 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 123.276 0.63 . . . . 74.23 111.439 179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -64.83 -31.21 52.86 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.498 0 C-N-CA 123.965 0.906 . . . . 62.44 111.346 -177.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.42 HG12 ' O ' ' B' ' 103' ' ' PHE . 47.1 mm -65.81 -51.45 61.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 O-C-N 121.78 -0.575 . . . . 65.34 110.789 172.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -63.31 -33.03 74.62 Favored 'General case' 0 CA--C 1.565 1.525 0 N-CA-C 112.8 0.667 . . . . 64.34 112.8 177.066 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.565 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -83.68 -49.06 9.52 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.69 0.796 . . . . 65.31 113.126 -174.157 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 34.6 t -113.48 -12.36 12.95 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 124.044 0.937 . . . . 72.41 112.906 -172.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 96.73 162.46 32.43 Favored Glycine 0 N--CA 1.479 1.534 0 N-CA-C 113.678 0.231 . . . . 30.43 113.678 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -60.99 -44.7 97.02 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.16 0.584 . . . . 51.55 110.759 171.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 86.8 p -60.75 -34.38 74.36 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.281 -0.872 . . . . 54.41 111.188 174.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -60.0 -53.45 45.72 Favored Glycine 0 C--N 1.354 1.573 0 O-C-N 123.367 0.417 . . . . 73.1 113.382 175.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 46.9 tp -66.93 -33.2 75.08 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 122.67 0.388 . . . . 74.52 111.475 177.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 54.5 m -60.93 -42.78 98.82 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.133 0.573 . . . . 73.05 110.54 173.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.41 -37.91 80.77 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.374 0.67 . . . . 72.04 111.855 176.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.568 HD21 ' HG3' ' B' ' 36' ' ' GLN . 53.8 mt -62.12 -53.24 58.26 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.388 0.275 . . . . 60.3 110.844 176.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.732 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 68.4 mt -61.51 -40.33 94.23 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.398 0.679 . . . . 74.35 111.646 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.478 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.8 tpt -62.46 -40.39 96.47 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 123.942 0.897 . . . . 74.41 111.94 179.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 13.8 t -75.83 -39.23 57.11 Favored 'General case' 0 N--CA 1.481 1.097 0 O-C-N 121.701 -0.625 . . . . 70.51 112.301 174.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -71.67 -17.97 62.21 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.893 0.701 . . . . 73.43 112.893 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.525 HG21 ' HG ' ' A' ' 85' ' ' LEU . 26.6 m -66.85 -33.62 64.64 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 CA-C-N 118.203 0.456 . . . . 73.42 110.24 167.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 49.0 mtm -78.09 -35.55 49.22 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 122.957 0.503 . . . . 65.32 110.389 -179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 9.2 mmmm -62.0 -39.1 91.06 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.325 1.05 . . . . 73.04 111.225 173.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.597 ' HB3' ' HB3' ' A' ' 126' ' ' LEU . 8.6 mt -74.56 -36.18 63.07 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 115.355 -0.839 . . . . 53.42 111.587 175.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -27.24 68.17 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 122.991 0.517 . . . . 62.14 111.607 169.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -74.82 -37.15 62.37 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.245 0.618 . . . . 74.31 109.892 173.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.471 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 46.2 tptt -68.45 -32.79 73.06 Favored 'General case' 0 CA--C 1.561 1.401 0 CA-C-N 116.432 -0.349 . . . . 42.42 111.335 172.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 126' ' ' LEU . 54.2 t -67.08 -48.67 78.34 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.027 0.531 . . . . 72.34 110.403 174.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.504 ' HA ' HG22 ' B' ' 134' ' ' THR . 9.2 pt20 -65.91 -31.1 71.84 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 122.226 0.21 . . . . 70.51 110.851 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.445 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 18.3 t70 -59.77 -54.28 48.08 Favored 'General case' 0 C--N 1.359 1.021 0 C-N-CA 123.789 0.836 . . . . 72.22 110.579 174.509 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.528 HD13 ' HB ' ' A' ' 134' ' ' THR . 14.1 mt -69.56 -37.6 77.08 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.9 -0.591 . . . . 71.32 111.812 -175.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.504 HG22 ' HA ' ' B' ' 131' ' ' GLN . 1.9 t -70.88 -27.44 63.82 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.123 0.169 . . . . 62.33 111.167 178.019 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -66.79 -42.53 85.85 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 122.97 0.508 . . . . 74.32 110.782 171.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.61 ' HB2' HD11 ' A' ' 137' ' ' LEU . 51.4 mt -80.87 -17.37 50.89 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.611 0.764 . . . . 71.32 112.052 179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 136' ' ' LEU . 1.3 tt -82.87 -45.17 14.56 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.765 -0.828 . . . . 72.41 108.765 175.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 90.0 p -69.33 -27.03 65.0 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.27 0.628 . . . . 74.12 111.93 173.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.1 m -144.38 88.04 1.91 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.431 0.692 . . . . 70.11 110.543 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -92.12 -52.9 4.48 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.988 0.899 . . . . 71.24 110.379 178.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 18.8 p-10 -168.26 -49.32 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 113.625 -1.625 . . . . 51.42 108.192 177.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 . . . . . 0 CA--C 1.573 1.846 0 C-N-CA 125.671 1.588 . . . . 72.2 114.416 169.13 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.111 0 CA-C-O 119.909 -0.384 . . . . 74.14 112.965 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.7 t -105.63 113.85 27.66 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.348 0.659 . . . . 73.52 110.015 177.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -138.08 -160.7 1.09 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.44 1.096 . . . . 72.41 110.93 -175.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -62.46 -41.68 98.93 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.481 0.712 . . . . 63.31 111.175 177.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -69.06 110.51 4.53 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.619 0.768 . . . . 54.42 111.065 177.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -73.56 84.89 1.56 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.762 -0.829 . . . . 72.04 108.762 170.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -83.39 125.72 31.97 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-O 121.402 0.62 . . . . 73.33 111.276 -172.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -80.93 -11.28 59.6 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 116.133 -0.485 . . . . 74.54 111.226 168.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -52.67 -36.74 57.49 Favored 'General case' 0 CA--C 1.559 1.304 0 C-N-CA 124.961 1.304 . . . . 64.43 113.445 179.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 2.4 p -64.39 -23.74 67.39 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 113.728 1.01 . . . . 71.05 113.728 178.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -57.16 -18.23 14.37 Favored 'General case' 0 N--CA 1.5 2.069 0 C-N-CA 123.466 0.706 . . . . 75.1 112.875 171.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.661 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 60.7 m -55.5 -30.93 61.54 Favored 'General case' 0 N--CA 1.488 1.462 0 N-CA-C 113.103 0.779 . . . . 63.21 113.103 174.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.3 -38.73 76.29 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.515 0 C-N-CA 123.616 0.766 . . . . 74.31 111.43 173.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 75.3 mt -86.43 -15.18 41.05 Favored 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 113.55 0.945 . . . . 72.25 113.55 -176.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.661 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 53.7 mm-40 -46.47 -61.35 1.84 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 114.889 1.44 . . . . 72.43 114.889 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -67.96 -7.23 48.9 Favored Glycine 0 N--CA 1.479 1.535 0 N-CA-C 114.083 0.393 . . . . 74.12 114.083 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -110.3 -6.79 14.93 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.052 0.941 . . . . 71.22 111.516 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 68.1 mtp180 -55.39 -38.08 68.41 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 123.12 0.568 . . . . 61.45 111.996 -177.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -62.86 -33.76 62.2 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 123.21 0.604 . . . . 64.01 112.257 178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.2 m -75.73 -47.89 24.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.609 0.763 . . . . 51.5 111.026 175.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.454 HD23 HD12 ' A' ' 90' ' ' LEU . 86.5 mt -58.07 -37.29 74.18 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 124.162 0.985 . . . . 63.34 111.719 179.047 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -77.9 -24.05 48.51 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.036 0.754 . . . . 74.21 113.036 177.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 t -83.49 -34.56 25.31 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 112.15 0.426 . . . . 71.13 112.15 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.591 HG11 HD21 ' A' ' 90' ' ' LEU . 99.7 t -90.91 -51.83 11.22 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 N-CA-C 112.69 0.626 . . . . 73.13 112.69 -175.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.405 HD11 ' HG ' ' A' ' 90' ' ' LEU . 3.6 mp -79.08 134.51 27.68 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 122.098 -0.376 . . . . 73.41 110.917 -173.636 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' A' ' 29' ' ' ARG . 5.3 m-20 -98.96 121.35 56.11 Favored Pre-proline 0 N--CA 1.485 1.28 0 C-N-CA 123.771 0.829 . . . . 72.35 110.692 -179.199 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.592 ' HD3' HG22 ' A' ' 61' ' ' VAL . 42.0 Cg_exo -54.66 -33.2 78.7 Favored 'Trans proline' 0 C--N 1.38 2.219 0 C-N-CA 122.692 2.261 . . . . 65.41 113.146 -177.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 42.7 t -61.71 -30.69 70.92 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.607 0.763 . . . . 62.52 112.334 -176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 26' ' ' ASP . 18.4 ptp180 -91.32 -27.59 18.29 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 112.512 0.56 . . . . 75.22 112.512 -175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 38.3 pt -94.74 -26.52 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 N-CA-C 113.165 0.802 . . . . 72.12 113.165 -176.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 26.1 p -58.92 -40.31 80.89 Favored Pre-proline 0 N--CA 1.5 2.043 0 N-CA-C 113.947 1.091 . . . . 51.3 113.947 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -61.88 -34.21 82.49 Favored 'Trans proline' 0 C--N 1.4 3.268 0 C-N-CA 122.125 1.883 . . . . 64.4 113.754 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -69.21 -44.88 71.19 Favored 'General case' 0 CA--C 1.556 1.207 0 CA-C-N 115.999 -0.546 . . . . 71.14 111.046 176.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.477 HD13 HD21 ' A' ' 68' ' ' LEU . 80.9 mt -62.57 -23.14 66.85 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 124.17 0.988 . . . . 74.13 112.694 179.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 28.3 mmm-85 -59.6 -51.19 70.88 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.158 0.583 . . . . 64.22 110.834 168.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.525 ' HG3' HD21 ' A' ' 118' ' ' LEU . 17.0 mm100 -64.73 -28.78 69.82 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.91 0.884 . . . . 72.24 111.869 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 21.4 m -74.88 -16.25 60.68 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.545 0.738 . . . . 74.01 111.554 173.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.622 ' HG2' ' HB1' ' A' ' 109' ' ' ALA . 74.6 mmtt 70.0 14.32 7.84 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 125.117 1.367 . . . . 73.31 112.663 175.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 34.6 m -100.93 9.59 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 C-N-CA 123.462 0.705 . . . . 63.51 111.962 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.507 HD21 ' HB3' ' A' ' 45' ' ' GLU . 10.4 tt -144.3 130.56 19.7 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.665 0.786 . . . . 75.12 109.998 -175.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.9 m-80 -100.48 158.94 31.0 Favored Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 124.247 1.019 . . . . 72.34 111.282 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -58.26 -18.58 38.26 Favored 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 123.184 2.589 . . . . 54.23 114.74 -179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -75.14 -41.56 58.05 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 122.976 0.51 . . . . 73.22 111.265 174.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.504 ' HB3' HD13 ' A' ' 67' ' ' ILE . 67.9 m-20 -63.84 -50.32 69.33 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.882 0.873 . . . . 74.43 112.885 -176.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.507 ' HB3' HD21 ' A' ' 40' ' ' LEU . 7.6 pt-20 -58.71 -35.8 73.23 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 116.031 -0.531 . . . . 71.35 111.407 178.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -74.53 -41.76 60.05 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.275 0.63 . . . . 70.5 112.342 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -72.93 -30.56 63.98 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 118.024 0.375 . . . . 74.1 111.685 -177.72 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.419 HG13 ' O ' ' A' ' 60' ' ' LYS . 73.1 t -71.97 -40.99 68.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 123.274 0.63 . . . . 74.12 112.116 176.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -97.68 13.76 29.16 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.029 0.381 . . . . 71.54 112.029 176.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 39.2 t -60.82 -34.1 74.03 Favored 'General case' 0 N--CA 1.501 2.118 0 C-N-CA 123.442 0.697 . . . . 53.0 112.094 177.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.584 ' HB3' ' HD3' ' A' ' 60' ' ' LYS . 12.0 t70 -94.4 136.18 23.57 Favored Pre-proline 0 CA--C 1.561 1.385 0 C-N-CA 124.019 0.927 . . . . 73.24 109.665 171.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -85.79 -44.64 0.05 OUTLIER 'Trans proline' 0 CA--C 1.571 2.349 0 C-N-CA 122.707 2.271 . . . . 74.43 114.837 178.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 10.8 p30 -61.22 147.19 45.15 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.531 1.308 . . . . 71.45 114.531 -166.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.61 ' HA ' ' HB2' ' A' ' 57' ' ' ARG . 2.5 pt? -75.86 -7.67 55.06 Favored 'General case' 0 N--CA 1.482 1.135 0 CA-C-N 114.663 -1.153 . . . . 73.21 112.834 175.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 42.8 t -60.8 -42.17 91.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 C-N-CA 123.331 0.653 . . . . 63.23 111.293 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.42 ' HB ' ' HG2' ' A' ' 59' ' ' ARG . 48.3 pt -114.21 23.72 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.435 0 C-N-CA 123.107 0.563 . . . . 71.23 112.019 175.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 54' ' ' LEU . 53.5 ttt-85 -52.0 -45.94 64.72 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.858 0.863 . . . . 71.4 112.457 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.0 mtmt -59.87 -42.97 94.88 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.386 0.675 . . . . 65.41 112.746 -178.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HG2' ' HB ' ' A' ' 56' ' ' ILE . 9.6 ptm180 -74.54 -19.64 60.26 Favored 'General case' 0 N--CA 1.483 1.213 0 O-C-N 121.485 -0.759 . . . . 74.31 111.857 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.584 ' HD3' ' HB3' ' A' ' 51' ' ' ASP . 57.5 mtmt -73.19 -40.33 64.86 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 118.082 0.401 . . . . 55.22 110.829 174.032 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.592 HG22 ' HD3' ' A' ' 27' ' ' PRO . 3.9 t -64.52 -37.23 79.5 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 109.111 -0.7 . . . . 52.03 109.111 169.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -60.19 -47.55 90.5 Favored Glycine 0 C--N 1.352 1.429 0 CA-C-N 114.848 -1.069 . . . . 34.04 113.823 178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 28.3 m -69.13 -29.28 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 CA-C-N 117.473 0.637 . . . . 73.12 111.042 179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 48.1 tp -64.57 -39.09 93.11 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 122.616 0.367 . . . . 75.04 111.524 171.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 61' ' ' VAL . 85.0 mt -63.27 -41.4 99.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 122.718 0.407 . . . . 74.53 111.117 175.236 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.451 ' O ' ' HG3' ' A' ' 70' ' ' ARG . 1.8 m-20 -60.37 -38.64 84.53 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.827 0.851 . . . . 72.51 111.785 172.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.504 HD13 ' HB3' ' A' ' 44' ' ' ASP . 45.0 mt -61.64 -49.75 83.07 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 123.86 0.864 . . . . 74.32 111.588 175.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.477 HD21 HD13 ' A' ' 34' ' ' LEU . 68.2 mt -65.14 -27.77 68.95 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.357 0.663 . . . . 74.43 111.643 173.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -73.12 -28.44 62.27 Favored 'General case' 0 CA--C 1.559 1.316 0 C-N-CA 123.141 0.576 . . . . 74.21 111.649 177.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.47 ' NH2' HG23 ' A' ' 67' ' ' ILE . 68.1 mtm180 -58.87 -30.66 67.9 Favored 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 123.13 0.572 . . . . 71.25 112.213 173.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 63.3 p -88.49 4.77 45.41 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.929 0.492 . . . . 34.32 110.286 178.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 62.33 -114.57 6.95 Favored Glycine 0 C--N 1.353 1.485 0 C-N-CA 124.1 0.857 . . . . 74.52 114.656 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.8 t60 -74.21 -27.28 60.72 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 124.151 0.98 . . . . 75.22 110.753 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.7 mmmm -57.11 -57.04 14.33 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.213 1.005 . . . . 73.31 112.216 177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.59 -28.46 73.16 Favored Glycine 0 CA--C 1.53 1.011 0 CA-C-N 115.983 -0.553 . . . . 61.24 113.948 178.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -57.61 -55.42 35.07 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.973 0.509 . . . . 63.03 111.009 170.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 72.9 t -54.97 -55.27 16.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 123.717 0.807 . . . . 52.11 110.373 175.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -60.86 -29.11 69.33 Favored 'General case' 0 CA--C 1.552 1.031 0 N-CA-C 113.147 0.795 . . . . 75.13 113.147 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -72.15 -47.21 52.64 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 118.208 0.458 . . . . 72.43 111.185 174.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB2' HG11 ' A' ' 102' ' ' VAL . 59.6 mt -63.82 -32.78 74.41 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-O 121.487 0.661 . . . . 61.01 111.193 179.03 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -68.63 -51.53 41.2 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.668 1.587 . . . . 72.11 111.621 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 71.0 m -57.24 -37.64 72.61 Favored 'General case' 0 N--CA 1.483 1.209 0 CA-C-N 115.665 -0.698 . . . . 71.42 109.985 172.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.405 HD12 ' HA ' ' A' ' 83' ' ' LEU . 13.2 tp -72.13 -40.94 67.74 Favored 'General case' 0 C--O 1.203 -1.353 0 CA-C-N 116.062 -0.517 . . . . 75.23 110.494 -177.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -62.75 -31.92 72.96 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 118.047 0.385 . . . . 74.2 111.25 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.47 HD21 ' HG3' ' A' ' 122' ' ' GLU . 7.0 tt -76.5 -63.11 1.41 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 122.651 0.38 . . . . 73.32 110.848 176.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 -74.95 -50.89 15.21 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.604 0.964 . . . . 74.13 113.604 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.438 ' HB3' HD23 ' A' ' 90' ' ' LEU . 97.5 m-85 -134.19 66.57 71.63 Favored Pre-proline 0 N--CA 1.501 2.082 0 O-C-N 121.721 -0.612 . . . . 71.13 112.475 -176.171 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -61.2 -20.03 66.23 Favored 'Trans proline' 0 C--N 1.386 2.539 0 C-N-CA 122.806 2.338 . . . . 73.31 113.776 179.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -72.58 -29.96 63.98 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.077 0.551 . . . . 71.11 111.609 172.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.591 HD21 HG11 ' A' ' 24' ' ' VAL . 3.9 mm? -70.41 -40.03 74.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.215 0.606 . . . . 71.42 110.166 173.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -65.0 -41.5 95.32 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-O 120.961 0.41 . . . . 73.1 110.454 172.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 53.3 tptt -54.86 -48.9 72.34 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 124.277 1.031 . . . . 71.32 111.805 175.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.531 ' HD3' HD13 ' A' ' 90' ' ' LEU . 19.4 ptmt -74.35 -28.63 61.22 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 112.795 0.665 . . . . 75.32 112.795 -176.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.689 HG23 HG23 ' A' ' 95' ' ' THR . 14.1 m -76.54 -47.71 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-N 118.606 0.639 . . . . 74.02 112.698 177.054 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.689 HG23 HG23 ' A' ' 94' ' ' VAL . 81.8 p -98.2 -44.55 6.54 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 113.688 0.996 . . . . 62.14 113.688 -176.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 126.44 -14.18 6.89 Favored Glycine 0 N--CA 1.484 1.895 0 N-CA-C 114.21 0.444 . . . . 42.33 114.21 -178.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -122.35 145.78 47.94 Favored 'General case' 0 N--CA 1.488 1.435 0 CA-C-N 117.403 0.602 . . . . 71.11 111.399 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -79.0 -50.53 1.4 Allowed Pre-proline 0 CA--C 1.565 1.54 0 C-N-CA 123.51 0.724 . . . . 74.21 111.071 173.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.0 100.72 0.87 Allowed 'Trans proline' 0 C--N 1.403 3.408 0 C-N-CA 121.925 1.75 . . . . 62.32 111.24 178.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -84.64 -38.62 19.63 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-N 115.686 -0.688 . . . . 62.45 111.3 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 56.3 58.92 3.94 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.328 1.051 . . . . 71.13 112.7 -178.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 0.542 HG11 ' HB2' ' A' ' 80' ' ' LEU . 7.4 t -118.71 -1.81 9.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.684 0 N-CA-C 112.247 0.462 . . . . 74.43 112.247 -170.126 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.476 ' O ' HG12 ' A' ' 107' ' ' ILE . 67.5 m-85 -65.14 0.25 1.4 Allowed 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 114.907 1.447 . . . . 74.41 114.907 -174.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 80.2 p -53.6 -33.41 54.8 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.537 1.135 . . . . 62.55 113.787 175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . 0.44 ' HB2' ' HE2' ' A' ' 105' ' ' MET . 47.4 tpp -65.87 -61.1 2.25 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 122.747 0.419 . . . . 63.44 110.941 -179.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.401 ' O ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -63.53 -30.16 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 C-N-CA 124.163 0.985 . . . . 63.32 111.635 -179.081 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.476 HG12 ' O ' ' A' ' 103' ' ' PHE . 45.4 mm -71.37 -42.46 73.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.239 -0.913 . . . . 74.15 111.365 173.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -65.79 -33.51 76.02 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 112.126 0.417 . . . . 70.11 112.126 173.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . 0.622 ' HB1' ' HG2' ' A' ' 38' ' ' LYS . . . -85.47 -62.18 1.59 Allowed 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.036 0.935 . . . . 75.42 112.622 -172.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 38.3 t -104.41 -22.22 13.35 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.607 0.763 . . . . 33.21 112.275 -176.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 94.7 175.1 38.4 Favored Glycine 0 N--CA 1.476 1.35 0 N-CA-C 114.511 0.565 . . . . 70.43 114.511 -178.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -70.33 -33.96 72.1 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.941 0.896 . . . . 75.44 111.678 -178.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 78.7 p -63.74 -46.51 85.0 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.884 0.874 . . . . 73.22 110.894 175.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.35 -45.11 94.72 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 115.799 -0.637 . . . . 62.22 112.902 175.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 39.4 tp -69.94 -29.56 66.73 Favored 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 122.684 0.394 . . . . 73.44 112.06 176.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 76.5 m -62.91 -44.09 97.02 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 109.812 -0.44 . . . . 73.24 109.812 173.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -63.45 -44.93 93.08 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.453 0.701 . . . . 74.11 111.458 176.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.525 HD21 ' HG3' ' A' ' 36' ' ' GLN . 99.4 mt -58.04 -60.57 3.53 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 115.547 -0.751 . . . . 61.11 111.085 176.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 74.2 mt -56.5 -33.6 66.16 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.532 0.733 . . . . 61.44 112.738 177.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.484 ' O ' HG22 ' A' ' 123' ' ' VAL . 0.0 OUTLIER -65.58 -48.88 70.86 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.312 0.645 . . . . 72.11 110.387 177.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 8.8 t -66.51 -38.47 87.29 Favored 'General case' 0 N--CA 1.482 1.138 0 O-C-N 121.892 -0.505 . . . . 70.43 110.638 176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 118' ' ' LEU . 75.4 mm-40 -59.55 -36.66 76.6 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.74 0.816 . . . . 72.15 112.86 -178.786 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.494 HG13 ' O ' ' A' ' 119' ' ' LEU . 6.7 m -66.03 -30.95 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.249 0 CA-C-N 118.265 0.484 . . . . 74.53 111.009 176.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . . . . . . . . . 72.9 mtm -81.99 -32.78 30.44 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.282 0.633 . . . . 64.33 110.57 -178.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -64.85 -33.5 76.15 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.729 1.212 . . . . 73.22 110.996 171.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.439 ' O ' HG23 ' A' ' 130' ' ' VAL . 16.4 mt -77.72 -36.46 50.94 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.025 0.93 . . . . 73.25 111.311 174.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 123' ' ' VAL . 77.4 mt-30 -64.09 -32.53 74.12 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 118.283 0.492 . . . . 73.23 111.372 170.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -70.79 -44.67 66.16 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.502 0.721 . . . . 44.41 109.3 174.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.527 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 56.6 tptt -58.54 -46.28 87.13 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.723 0.809 . . . . 73.31 111.125 174.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 126' ' ' LEU . 36.4 t -61.79 -49.85 82.6 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 124.195 0.998 . . . . 62.11 110.9 179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.74 ' HA ' HG22 ' A' ' 134' ' ' THR . 8.4 pt20 -69.39 -25.71 64.28 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 119.683 -0.199 . . . . 73.41 111.483 -178.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -67.88 -40.33 83.54 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 123.147 0.579 . . . . 54.32 109.996 174.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 20.0 mt -78.51 -34.54 47.3 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.722 -0.672 . . . . 75.35 111.075 -176.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.74 HG22 ' HA ' ' A' ' 131' ' ' GLN . 4.9 t -79.83 -21.33 44.31 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 122.372 0.269 . . . . 74.54 111.118 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.02 -37.77 88.73 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.263 0.554 . . . . 42.54 111.049 171.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.514 ' HB2' HD11 ' B' ' 137' ' ' LEU . 55.7 mt -84.46 -35.71 22.82 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.694 0.797 . . . . 63.34 110.799 178.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.619 HD11 ' HB2' ' B' ' 136' ' ' LEU . 1.0 OUTLIER -62.91 -24.14 67.7 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 123.567 0.747 . . . . 45.45 111.882 166.254 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.0 t -79.38 -45.13 20.13 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.929 0.492 . . . . 61.13 110.963 172.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 54.1 m -142.49 99.24 3.45 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.04 0.936 . . . . 74.34 109.783 -177.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.461 ' HD2' ' HD3' ' B' ' 140' ' ' LYS . 61.2 tttm -100.82 -45.11 5.56 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.315 0.646 . . . . 71.41 111.564 -174.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 35.0 t70 58.75 92.48 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.292 0 C-N-CA 124.882 1.273 . . . . 62.43 111.238 -174.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 . . . . . 0 CA--C 1.567 1.602 0 C-N-CA 125.163 1.385 . . . . 73.44 111.943 -171.711 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.082 0 CA-C-O 120.803 0.113 . . . . 64.41 113.017 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 50.3 m -83.68 28.29 0.58 Allowed 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 123.752 0.821 . . . . 74.14 112.91 -175.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -59.55 134.66 57.22 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.192 0.997 . . . . 72.11 112.494 -177.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 94.2 m-85 -86.42 -51.18 6.37 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 122.908 0.483 . . . . 75.11 110.172 173.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -62.71 123.14 17.63 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.009 0.924 . . . . 72.3 111.678 178.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . 0.602 ' HB3' ' HA3' ' B' ' 72' ' ' GLY . 11.2 m120 -59.0 98.22 0.04 OUTLIER 'General case' 0 CA--C 1.562 1.42 0 C-N-CA 125.158 1.383 . . . . 64.42 112.517 -176.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -100.09 113.96 26.96 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.468 0.651 . . . . 63.54 112.132 -175.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -81.71 -10.26 59.43 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 113.138 0.792 . . . . 72.04 113.138 172.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 13.8 mm-40 -50.3 -32.52 17.24 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 113.367 0.877 . . . . 73.53 113.367 173.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 4.6 p -67.26 -27.66 67.39 Favored 'General case' 0 CA--C 1.559 1.309 0 N-CA-C 113.428 0.899 . . . . 72.12 113.428 179.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 61.2 m95 -47.11 -19.83 0.14 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.753 1.761 . . . . 73.23 115.753 171.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 51.0 m -52.77 -30.83 35.13 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.719 1.007 . . . . 63.52 113.719 -175.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 65.2 t -63.02 -44.48 99.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 C-N-CA 124.002 0.921 . . . . 75.23 111.629 176.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.2 mt -78.85 -35.7 43.52 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-N 115.6 -0.727 . . . . 75.22 111.649 178.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -63.0 -36.16 82.64 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.48 0.712 . . . . 75.44 112.476 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -57.87 -14.73 17.38 Favored Glycine 0 CA--C 1.543 1.825 0 N-CA-C 114.367 0.507 . . . . 65.25 114.367 170.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . 0.4 ' HB3' ' HB ' ' B' ' 20' ' ' THR . 96.3 m-85 -132.2 28.57 4.41 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.214 1.006 . . . . 74.53 111.258 173.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 4.6 tpp180 -51.62 -52.43 47.7 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 123.169 0.588 . . . . 61.41 111.279 178.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 11.3 p -63.53 -29.76 48.09 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.584 0 C-N-CA 123.433 0.693 . . . . 75.42 112.554 178.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . 0.4 ' HB ' ' HB3' ' B' ' 17' ' ' PHE . 87.5 m -69.33 -52.14 30.12 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 123.149 0.579 . . . . 50.45 110.752 176.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . 84.5 mt -59.36 -40.08 85.32 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.368 1.067 . . . . 75.42 111.471 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.467 ' HA ' ' HB ' ' B' ' 61' ' ' VAL . 73.2 p -68.6 -35.94 78.02 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.702 0.63 . . . . 74.33 112.702 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 41.4 t -76.91 -39.32 51.28 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.799 0.439 . . . . 62.53 112.046 -178.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.685 HG11 HD21 ' B' ' 90' ' ' LEU . 57.7 t -81.19 -54.83 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.044 0.45 . . . . 51.11 112.143 -177.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 28.2 mt -79.38 158.8 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.303 0 C-N-CA 123.35 0.66 . . . . 71.23 111.624 -169.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.454 ' O ' ' HG2' ' B' ' 29' ' ' ARG . 1.5 t70 -122.39 131.27 24.42 Favored Pre-proline 0 CA--C 1.555 1.155 0 C-N-CA 124.316 1.046 . . . . 71.51 109.485 172.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.3 Cg_exo -55.57 -39.57 90.31 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.469 2.113 . . . . 75.24 112.724 -176.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 40.6 t -62.77 -24.72 67.86 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 113.122 0.786 . . . . 60.45 113.122 -176.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' B' ' 26' ' ' ASP . 5.5 ptp180 -95.0 1.17 55.14 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 112.773 0.657 . . . . 72.33 112.773 -178.262 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 33.5 pt -123.92 -26.41 1.78 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.124 0 C-N-CA 123.016 0.526 . . . . 71.22 112.338 176.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.518 HG22 HD11 ' B' ' 40' ' ' LEU . 18.2 p -59.03 -43.09 97.01 Favored Pre-proline 0 N--CA 1.494 1.741 0 N-CA-C 114.174 1.175 . . . . 74.42 114.174 -178.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -66.87 -28.51 42.64 Favored 'Trans proline' 0 C--N 1.4 3.267 0 CA-C-N 121.872 1.704 . . . . 72.33 112.845 178.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.464 ' HE1' ' HG3' ' B' ' 81' ' ' GLU . 61.2 t80 -70.27 -49.12 52.99 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.377 0.671 . . . . 74.21 110.342 173.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.496 HD13 HD21 ' B' ' 68' ' ' LEU . 78.1 mt -58.26 -25.53 61.85 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 124.324 1.05 . . . . 71.5 112.954 177.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 58.0 mmm-85 -58.62 -51.1 71.37 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.345 0.658 . . . . 61.54 111.288 169.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.614 ' HG3' HD21 ' B' ' 118' ' ' LEU . 15.2 mm100 -72.11 -26.25 62.06 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.703 0.801 . . . . 70.3 111.027 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 35.3 m -72.39 -11.63 60.77 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.695 0.798 . . . . 60.21 111.026 169.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.508 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 73.8 mmtt 72.54 8.51 5.68 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 125.203 1.401 . . . . 61.23 113.129 170.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 24.4 m -99.87 6.62 9.4 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 C-N-CA 123.686 0.794 . . . . 74.21 112.436 -178.637 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.518 HD11 HG22 ' B' ' 31' ' ' THR . 6.7 tt -139.29 125.85 20.54 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.237 0.615 . . . . 71.24 110.064 -176.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' HD23 ' B' ' 40' ' ' LEU . 33.5 m-80 -85.07 154.56 60.6 Favored Pre-proline 0 N--CA 1.482 1.145 0 C-N-CA 124.159 0.984 . . . . 70.21 110.157 176.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -58.88 -26.67 81.74 Favored 'Trans proline' 0 C--N 1.379 2.17 0 C-N-CA 121.885 1.723 . . . . 51.55 111.779 174.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.82 -38.17 89.68 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 124.54 1.136 . . . . 75.15 111.991 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.404 ' HA ' HE21 ' B' ' 47' ' ' GLN . 69.8 m-20 -66.93 -61.58 1.87 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.4 0.68 . . . . 54.02 112.079 -177.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -50.34 -31.59 14.99 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 113.013 0.746 . . . . 70.22 113.013 174.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.67 -52.7 23.35 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.081 0.552 . . . . 73.52 111.87 174.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . 0.404 HE21 ' HA ' ' B' ' 44' ' ' ASP . 30.4 pt20 -70.89 -27.03 63.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 112.396 0.517 . . . . 75.33 112.396 -176.014 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -75.77 -57.07 6.84 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.199 0 C-N-CA 123.066 0.546 . . . . 70.14 110.536 175.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.35 16.55 2.46 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 112.12 0.415 . . . . 70.42 112.12 178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 41.0 t -58.95 -34.75 72.13 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.051 0.941 . . . . 73.21 110.738 166.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.531 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 2.4 m-20 -120.68 90.24 45.9 Favored Pre-proline 0 CA--C 1.559 1.316 0 N-CA-C 107.236 -1.394 . . . . 71.51 107.236 168.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -87.94 -11.45 4.62 Favored 'Trans proline' 0 CA--C 1.556 1.613 0 C-N-CA 123.02 2.48 . . . . 74.43 114.994 -170.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 27.9 p30 -62.0 157.29 19.06 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 113.662 0.986 . . . . 61.14 113.662 -168.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.713 ' HA ' ' HD2' ' B' ' 57' ' ' ARG . 2.1 pt? -59.88 -21.63 61.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 114.558 -1.201 . . . . 71.35 113.65 -177.093 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 21.4 t -64.5 -48.9 83.09 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 C-N-CA 123.823 0.849 . . . . 75.11 111.17 -176.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . 0.429 ' O ' ' HG2' ' B' ' 60' ' ' LYS . 2.1 pp -122.82 7.17 5.44 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 113.954 1.094 . . . . 64.42 113.954 -173.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.713 ' HD2' ' HA ' ' B' ' 54' ' ' LEU . 8.7 ptm180 -61.32 -22.2 64.69 Favored 'General case' 0 N--CA 1.505 2.281 0 CA-C-N 118.669 0.668 . . . . 63.2 111.689 178.601 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -64.21 -57.83 8.33 Favored 'General case' 0 CA--C 1.557 1.22 0 C-N-CA 124.158 0.983 . . . . 72.25 111.831 178.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -63.36 -24.11 67.7 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 123.162 0.585 . . . . 50.24 111.999 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.531 ' HE3' ' HB2' ' B' ' 51' ' ' ASP . 74.6 mmtt -61.67 -32.47 72.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.268 0.627 . . . . 73.44 112.359 173.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.467 ' HB ' ' HA ' ' B' ' 22' ' ' THR . 25.5 t -66.35 -41.92 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 N-CA-C 109.99 -0.374 . . . . 64.31 109.99 172.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.08 -48.58 85.3 Favored Glycine 0 C--N 1.349 1.303 0 CA-C-N 115.973 -0.558 . . . . 73.31 113.407 179.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' B' ' 60' ' ' LYS . 17.5 m -67.33 -29.44 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 CA-C-O 120.59 0.233 . . . . 74.11 111.047 177.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 42.8 tp -68.1 -38.29 82.15 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.233 0.613 . . . . 71.32 111.485 175.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' B' ' 61' ' ' VAL . 96.4 mt -62.5 -35.85 80.67 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.243 0.617 . . . . 54.2 110.809 175.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . 0.573 ' HA ' ' HG2' ' B' ' 69' ' ' GLN . 60.8 m-20 -71.9 -28.09 63.27 Favored 'General case' 0 CA--C 1.553 1.088 0 CA-C-N 115.331 -0.849 . . . . 72.41 111.918 174.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . 0.558 ' O ' ' HG2' ' B' ' 70' ' ' ARG . 54.4 mt -72.69 -34.93 48.82 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.248 0 CA-C-O 121.326 0.584 . . . . 64.02 110.855 169.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.496 HD21 HD13 ' B' ' 34' ' ' LEU . 95.0 mt -75.63 -27.28 58.36 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 121.822 -0.549 . . . . 60.31 111.553 179.107 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . 0.573 ' HG2' ' HA ' ' B' ' 66' ' ' ASP . 10.3 pt20 -78.89 -23.64 44.68 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 112.648 0.61 . . . . 73.42 112.648 175.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.558 ' HG2' ' O ' ' B' ' 67' ' ' ILE . 8.7 ptm180 -68.73 -11.79 60.69 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 119.292 0.951 . . . . 74.51 111.575 176.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.9 p -85.54 -9.34 57.51 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.214 0.606 . . . . 74.33 111.013 174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . 0.602 ' HA3' ' HB3' ' B' ' 6' ' ' ASN . . . 64.66 92.37 0.03 OUTLIER Glycine 0 C--N 1.358 1.753 0 CA-C-O 118.692 -1.06 . . . . 31.24 114.75 178.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t60 76.09 -40.37 0.39 Allowed 'General case' 0 N--CA 1.507 2.404 0 CA-C-N 118.132 0.966 . . . . 73.1 112.456 174.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 45.3 mtmt -59.49 -48.81 80.2 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.217 1.007 . . . . 60.23 112.055 -176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.71 -28.99 74.15 Favored Glycine 0 CA--C 1.531 1.065 0 O-C-N 123.805 0.691 . . . . 75.03 113.644 176.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.438 ' O ' ' HG ' ' B' ' 80' ' ' LEU . 65.4 t80 -61.3 -54.92 37.73 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.256 0.622 . . . . 73.04 110.635 171.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 92.4 t -63.68 -42.45 96.05 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 C-N-CA 124.052 0.941 . . . . 54.22 111.316 -177.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -64.88 -36.52 84.63 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 114.895 -1.048 . . . . 73.2 111.686 176.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 56.2 t80 -70.16 -33.45 71.79 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-O 119.644 -0.217 . . . . 74.22 110.97 173.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.532 ' HB2' HG11 ' B' ' 102' ' ' VAL . 98.4 mt -60.98 -48.45 81.78 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 122.501 0.321 . . . . 64.53 111.561 175.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.464 ' HG3' ' HE1' ' B' ' 33' ' ' TYR . 22.8 pt-20 -70.51 -35.5 73.25 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 112.076 0.398 . . . . 75.12 112.076 177.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 74.5 m -57.53 -42.08 82.18 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.101 0.477 . . . . 61.32 110.671 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 14.0 tp -80.66 -35.16 34.17 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 116.27 -0.423 . . . . 62.3 111.437 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -61.27 -29.51 69.89 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.656 0.782 . . . . 71.33 110.256 175.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.406 ' HB2' ' HE1' ' B' ' 103' ' ' PHE . 6.5 tt -87.06 -66.42 0.91 Allowed 'General case' 0 CA--C 1.558 1.265 0 CA-C-N 115.11 -0.95 . . . . 71.22 110.877 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -71.56 -37.55 71.08 Favored 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 113.612 0.968 . . . . 73.25 113.612 -171.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.542 ' HB3' HD23 ' B' ' 90' ' ' LEU . 84.0 m-85 -135.67 75.43 56.64 Favored Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 122.184 -0.322 . . . . 64.1 111.23 -176.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -57.31 -35.05 98.85 Favored 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 123.121 2.547 . . . . 74.21 113.013 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . 0.425 ' HG3' HD22 ' B' ' 90' ' ' LEU . 16.4 pt20 -67.38 -41.4 85.07 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.843 0.857 . . . . 71.13 112.427 175.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.685 HD21 HG11 ' B' ' 24' ' ' VAL . 4.3 mm? -65.98 -40.73 91.48 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.938 0.495 . . . . 52.22 110.694 175.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -66.07 -44.34 84.76 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.031 -0.532 . . . . 74.4 110.847 179.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 4.7 tmmm? -64.32 -38.64 91.75 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.247 -0.888 . . . . 72.55 111.789 178.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.544 ' HD3' HD13 ' B' ' 90' ' ' LEU . 0.1 OUTLIER -74.44 -34.75 63.27 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 118.224 0.465 . . . . 65.4 112.115 -179.406 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.467 HG23 HG23 ' B' ' 95' ' ' THR . 17.9 m -73.64 -43.14 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 112.855 0.687 . . . . 54.4 112.855 176.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . 0.467 HG23 HG23 ' B' ' 94' ' ' VAL . 63.6 p -89.59 -43.97 10.41 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 113.12 0.785 . . . . 55.34 113.12 -175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 114.54 -3.66 23.28 Favored Glycine 0 N--CA 1.484 1.899 0 N-CA-C 115.158 0.823 . . . . 15.41 115.158 -179.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -138.86 152.26 47.67 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-N 118.139 0.97 . . . . 73.23 112.326 -176.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . 0.607 ' HB2' ' HD3' ' B' ' 99' ' ' PRO . 45.5 mm-40 -67.54 -56.87 11.3 Favored Pre-proline 0 CA--C 1.575 1.922 0 C-N-CA 123.693 0.797 . . . . 72.23 112.078 -179.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.607 ' HD3' ' HB2' ' B' ' 98' ' ' GLU . 19.6 Cg_endo -97.78 160.15 0.89 Allowed 'Trans proline' 0 C--N 1.397 3.113 0 C-N-CA 122.288 1.992 . . . . 64.31 113.294 177.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -151.19 -16.17 0.21 Allowed 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 114.68 1.363 . . . . 42.12 114.68 175.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 10.7 mtp85 56.22 62.32 2.39 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 113.944 1.091 . . . . 72.11 113.944 -177.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . 0.532 HG11 ' HB2' ' B' ' 80' ' ' LEU . 11.4 t -107.33 -9.62 10.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 CA-C-N 115.984 -0.553 . . . . 70.14 110.988 -173.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.516 ' O ' HG12 ' B' ' 107' ' ' ILE . 66.0 m-85 -59.09 -12.85 5.44 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 113.661 0.986 . . . . 71.32 113.661 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 86.9 p -56.4 -28.29 58.89 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.533 0.733 . . . . 75.01 112.642 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 6.1 tpt -64.72 -54.87 24.74 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.589 0.755 . . . . 74.23 111.044 178.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.435 ' HA ' ' HB3' ' B' ' 109' ' ' ALA . 0.0 OUTLIER -69.62 -23.86 26.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 C-N-CA 123.813 0.845 . . . . 62.44 110.827 177.887 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.516 HG12 ' O ' ' B' ' 103' ' ' PHE . 46.7 mm -67.89 -44.41 85.27 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 O-C-N 121.575 -0.703 . . . . 65.34 111.179 172.433 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -70.88 -31.73 68.49 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.657 0.614 . . . . 64.34 112.657 171.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.508 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -79.33 -48.03 14.78 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 113.244 0.831 . . . . 65.31 113.244 -173.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 32.0 t -123.05 -8.46 8.28 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 123.805 0.842 . . . . 72.41 112.626 -175.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 98.35 164.92 30.88 Favored Glycine 0 N--CA 1.481 1.69 0 N-CA-C 114.067 0.387 . . . . 30.43 114.067 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.65 -46.98 85.72 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 123.196 0.598 . . . . 51.55 110.957 173.66 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 92.3 p -64.55 -29.06 70.08 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.483 0.713 . . . . 54.41 111.413 175.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.08 -55.63 28.48 Favored Glycine 0 C--N 1.355 1.619 0 O-C-N 123.25 0.344 . . . . 73.1 113.025 174.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 49.6 tp -64.34 -34.88 79.18 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.687 0.395 . . . . 74.52 111.684 175.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 74.7 m -57.62 -47.92 80.87 Favored 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 123.104 0.562 . . . . 73.05 110.296 174.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -67.47 -38.28 84.19 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 112.929 0.715 . . . . 72.04 112.929 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . 0.614 HD21 ' HG3' ' B' ' 36' ' ' GLN . 58.0 mt -59.4 -54.6 44.86 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.591 0.356 . . . . 60.3 111.31 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 82.4 mt -58.68 -48.08 82.32 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.549 0.74 . . . . 74.35 111.142 175.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . 0.447 ' O ' HG22 ' B' ' 123' ' ' VAL . 7.5 tpt -53.05 -48.33 67.74 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 114.189 1.181 . . . . 74.41 114.189 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 10.0 t -70.82 -39.49 73.02 Favored 'General case' 0 N--CA 1.482 1.174 0 O-C-N 121.793 -0.567 . . . . 70.51 111.738 174.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -64.5 -32.74 74.51 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.274 0.629 . . . . 73.43 112.614 -174.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.47 ' O ' ' HG3' ' B' ' 127' ' ' GLN . 26.1 m -60.53 -33.17 53.47 Favored 'Isoleucine or valine' 0 C--N 1.358 0.948 0 N-CA-C 110.289 -0.263 . . . . 73.42 110.289 175.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . . . . . . . . . 73.6 mtm -76.13 -36.99 58.58 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.846 0.458 . . . . 65.32 110.445 -178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -56.57 -53.46 57.37 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.19 0.596 . . . . 73.04 110.379 171.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.459 ' O ' HG23 ' B' ' 130' ' ' VAL . 18.7 mt -53.3 -38.87 63.52 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 124.446 1.098 . . . . 53.42 113.097 171.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . 0.47 ' HG3' ' O ' ' B' ' 123' ' ' VAL . 71.1 mt-30 -68.02 -29.13 68.06 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 112.495 0.554 . . . . 62.14 112.495 175.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . . . . . . . . . 13.1 mptt -69.77 -43.21 72.66 Favored 'General case' 0 N--CA 1.491 1.581 0 CA-C-O 120.824 0.345 . . . . 74.31 110.345 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.487 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 56.2 tptt -58.97 -42.99 91.25 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 123.63 0.772 . . . . 42.42 111.191 172.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.459 HG23 ' O ' ' B' ' 126' ' ' LEU . 39.8 t -64.49 -51.63 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 C-N-CA 124.096 0.958 . . . . 72.34 111.299 178.674 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.515 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -66.2 -30.28 70.7 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 122.351 0.26 . . . . 70.51 110.95 -176.344 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' B' ' 136' ' ' LEU . 31.0 t70 -63.93 -53.32 52.26 Favored 'General case' 0 C--N 1.357 0.903 0 N-CA-C 109.363 -0.606 . . . . 72.22 109.363 174.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 15.5 mt -61.64 -39.66 92.13 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 122.897 0.479 . . . . 71.32 112.148 -178.205 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.515 HG22 ' HA ' ' B' ' 131' ' ' GLN . 2.3 t -73.39 -30.6 63.38 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.483 0.313 . . . . 62.33 111.462 -179.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -65.35 -41.65 93.63 Favored 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 122.942 0.497 . . . . 74.32 110.846 170.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' A' ' 137' ' ' LEU . 39.8 mt -79.99 -17.37 53.07 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.496 0.718 . . . . 71.32 111.684 178.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -81.56 -55.51 4.62 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.343 0.657 . . . . 72.41 109.38 177.2 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 33.6 t -62.57 -28.68 70.05 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.759 0.823 . . . . 74.12 112.503 -176.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 70.0 m -132.04 85.9 2.29 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 108.548 -0.908 . . . . 70.11 108.548 171.169 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.461 ' HD3' ' HD2' ' A' ' 140' ' ' LYS . 59.2 tttm -97.71 -47.45 5.6 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.815 0.672 . . . . 71.24 112.815 -171.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 30.2 t70 59.17 37.31 24.01 Favored 'General case' 0 CA--C 1.566 1.582 0 O-C-N 124.466 1.104 . . . . 51.42 111.085 -179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 . . . . . 0 CA--C 1.566 1.559 0 C-N-CA 124.99 1.316 . . . . 72.2 112.351 -175.756 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.928 0 CA-C-O 120.089 -0.284 . . . . 74.14 112.525 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.5 m -86.07 55.96 3.77 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.4 0.68 . . . . 73.52 110.828 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -152.46 173.24 15.37 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 123.713 0.805 . . . . 72.41 110.822 -176.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 94.8 m-85 -97.33 -3.19 40.93 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 123.716 0.807 . . . . 63.31 112.346 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -95.86 18.46 13.16 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.597 0.759 . . . . 54.42 111.85 -178.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 72.2 m-20 -57.74 110.29 0.87 Allowed 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 123.858 0.863 . . . . 72.04 111.259 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.01 96.86 0.1 Allowed 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.509 0.929 . . . . 73.33 113.509 -177.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -80.62 -21.45 41.5 Favored 'General case' 0 CA--C 1.562 1.419 0 N-CA-C 108.242 -1.022 . . . . 74.54 108.242 151.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -55.67 -63.4 1.18 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 125.792 1.637 . . . . 64.43 113.316 -179.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 80.7 m -70.45 -32.5 70.1 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.909 -0.587 . . . . 71.05 111.436 -175.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.42 ' O ' ' HG2' ' A' ' 15' ' ' GLU . 75.2 m95 -64.34 -26.31 68.42 Favored 'General case' 0 CA--C 1.546 0.805 0 N-CA-C 113.293 0.849 . . . . 75.1 113.293 171.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.456 ' HA ' ' HG2' ' A' ' 15' ' ' GLU . 62.7 m -61.41 -25.33 67.13 Favored 'General case' 0 N--CA 1.496 1.865 0 CA-C-N 118.368 0.531 . . . . 63.21 111.866 172.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 56.4 t -69.71 -32.97 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.326 0 C-N-CA 123.814 0.846 . . . . 74.31 110.747 173.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 97.4 mt -85.77 -30.32 23.14 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 113.25 0.833 . . . . 72.25 113.25 179.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 42.2 mm-40 -47.63 -54.72 11.1 Favored 'General case' 0 N--CA 1.507 2.391 0 N-CA-C 114.214 1.191 . . . . 72.43 114.214 -170.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -62.27 -17.95 57.12 Favored Glycine 0 CA--C 1.536 1.396 0 N-CA-C 114.337 0.495 . . . . 74.12 114.337 179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -100.09 -11.6 20.38 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.58 0.752 . . . . 71.22 111.886 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.471 ' HG2' HD12 ' A' ' 21' ' ' LEU . 27.2 mtm180 -62.25 -24.7 67.41 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 113.812 1.042 . . . . 61.45 113.812 -172.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 12.8 p -62.86 -36.01 73.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-N 118.452 0.569 . . . . 64.01 111.212 171.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 28.7 m -83.35 -37.76 22.93 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.142 0.977 . . . . 51.5 110.735 178.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.616 HD23 HD12 ' A' ' 90' ' ' LEU . 89.0 mt -61.11 -40.62 94.46 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.566 0.746 . . . . 63.34 110.823 176.035 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.456 ' HB ' ' HA ' ' A' ' 58' ' ' LYS . 47.5 p -70.82 -28.27 64.5 Favored 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 112.587 0.588 . . . . 74.21 112.587 177.002 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.4 m -73.57 -56.41 5.06 Favored 'General case' 0 N--CA 1.487 1.408 0 CA-C-O 121.712 0.768 . . . . 71.13 110.839 177.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.455 HG11 HD21 ' A' ' 90' ' ' LEU . 80.0 t -73.8 -44.36 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 CA-C-N 114.642 -1.163 . . . . 73.13 112.39 -170.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 39.7 mt -84.85 155.69 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 123.651 0.78 . . . . 73.41 111.498 -175.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -137.38 129.8 16.82 Favored Pre-proline 0 CA--C 1.56 1.339 0 C-N-CA 123.052 0.541 . . . . 72.35 109.995 171.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.782 ' HD3' HG22 ' A' ' 61' ' ' VAL . 41.8 Cg_exo -60.22 -5.91 4.57 Favored 'Trans proline' 0 C--N 1.377 2.069 0 C-N-CA 123.77 2.98 . . . . 65.41 115.344 -177.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 95.1 p -76.73 -30.11 56.47 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-N 119.125 0.875 . . . . 62.52 110.104 177.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 16.5 ptp180 -93.79 -35.76 12.6 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 112.762 0.653 . . . . 75.22 112.762 -179.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.404 HG12 ' HA ' ' A' ' 27' ' ' PRO . 48.5 pt -83.41 -26.88 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 CA-C-N 118.771 0.714 . . . . 72.12 112.3 -175.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.3 m -54.58 -50.55 84.81 Favored Pre-proline 0 N--CA 1.493 1.688 0 CA-C-O 117.653 -1.165 . . . . 51.3 113.357 -179.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -52.99 -38.49 79.93 Favored 'Trans proline' 0 C--N 1.395 2.986 0 C-N-CA 122.352 2.034 . . . . 64.4 113.381 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 7.3 t80 -66.89 -53.55 31.02 Favored 'General case' 0 CA--C 1.558 1.251 0 C-N-CA 122.648 0.379 . . . . 71.14 111.1 176.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.3 mt -59.92 -24.57 64.45 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 124.308 1.043 . . . . 74.13 112.531 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.7 mmm-85 -56.24 -61.18 2.57 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.457 1.103 . . . . 64.22 110.593 172.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -70.19 -18.13 63.17 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.659 0.784 . . . . 72.24 112.108 -177.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 70.8 m -76.86 -10.45 59.38 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.186 0.594 . . . . 74.01 112.022 171.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.9 mmpt? 69.92 6.07 5.56 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 125.044 1.337 . . . . 73.31 112.93 174.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 31.6 m -89.07 -37.5 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 C-N-CA 123.441 0.696 . . . . 63.51 111.461 -175.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.799 HD21 ' HB3' ' A' ' 45' ' ' GLU . 7.3 tt -84.11 130.36 34.86 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.439 1.096 . . . . 75.12 110.463 176.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -98.2 154.43 37.68 Favored Pre-proline 0 CA--C 1.572 1.818 0 C-N-CA 123.895 0.878 . . . . 72.34 112.884 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -62.01 -28.68 80.76 Favored 'Trans proline' 0 C--N 1.394 2.932 0 C-N-CA 124.197 3.265 . . . . 54.23 115.552 -172.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -81.4 -36.94 28.92 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 121.788 0.804 . . . . 73.22 110.968 -178.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.66 ' HB3' HD13 ' A' ' 67' ' ' ILE . 17.4 m-20 -69.59 -49.3 55.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 114.275 -1.33 . . . . 74.43 111.831 -174.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.799 ' HB3' HD21 ' A' ' 40' ' ' LEU . 12.8 pt-20 -51.22 -36.75 43.24 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.55 0.574 . . . . 71.35 112.55 172.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -72.98 -47.62 43.71 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.293 0.637 . . . . 70.5 111.786 -179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.438 ' HG2' ' HA ' ' A' ' 44' ' ' ASP . 20.6 pt20 -70.12 -24.13 63.14 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 112.269 0.47 . . . . 74.1 112.269 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 97.2 t -79.38 -45.13 23.87 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 C-N-CA 123.241 0.616 . . . . 74.12 110.994 173.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -81.41 10.44 5.71 Favored 'General case' 0 N--CA 1.499 1.994 0 C-N-CA 123.485 0.714 . . . . 71.54 112.304 176.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 48.1 t -58.11 -31.73 67.43 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.47 0.708 . . . . 53.0 110.734 169.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.444 ' HB3' ' ND2' ' A' ' 53' ' ' ASN . 17.7 m-20 -114.74 91.05 24.14 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 123.731 0.812 . . . . 73.24 110.106 169.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_exo -59.8 -17.0 40.88 Favored 'Trans proline' 0 C--N 1.378 2.108 0 C-N-CA 122.857 2.371 . . . . 74.43 114.511 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.444 ' ND2' ' HB3' ' A' ' 51' ' ' ASP . 10.2 p30 -62.74 155.16 27.37 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 113.369 0.877 . . . . 71.45 113.369 -178.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.624 ' HB2' HH11 ' A' ' 57' ' ' ARG . 2.1 pt? -95.37 22.88 6.4 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 123.503 0.721 . . . . 73.21 112.05 174.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 51.3 t -81.28 -56.34 6.45 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 122.093 -0.379 . . . . 63.23 111.251 -179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 46.8 pt -92.62 24.82 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 N-CA-C 114.082 1.142 . . . . 71.23 114.082 -171.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.654 ' HA ' ' HB3' ' A' ' 60' ' ' LYS . 17.5 mtp180 -50.74 -25.24 4.12 Favored 'General case' 0 N--CA 1.505 2.297 0 N-CA-C 114.547 1.314 . . . . 71.4 114.547 -173.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.456 ' HA ' ' HB ' ' A' ' 22' ' ' THR . 44.0 mmtm -56.71 -48.66 77.23 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.425 0.69 . . . . 65.41 111.878 174.14 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -85.73 -37.58 19.2 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 111.478 0.177 . . . . 74.31 111.478 174.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.654 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 87.2 tttt -58.14 -54.31 48.42 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.24 1.016 . . . . 55.22 112.226 -175.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.782 HG22 ' HD3' ' A' ' 27' ' ' PRO . 19.1 t -71.3 -40.51 73.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 N-CA-C 110.006 -0.368 . . . . 52.03 110.006 174.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -56.46 -42.89 90.32 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 114.949 -1.023 . . . . 34.04 114.99 -173.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 23.6 m -67.78 -39.97 82.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 122.809 0.444 . . . . 73.12 110.914 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.543 ' HA ' HD12 ' A' ' 67' ' ' ILE . 33.5 tp -65.56 -34.96 79.46 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.195 0.598 . . . . 75.04 111.357 -179.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.7 mt -62.47 -45.38 93.29 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.13 0.572 . . . . 74.53 111.808 176.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 49.6 m-20 -67.63 -28.11 67.45 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 122.881 0.473 . . . . 72.51 112.01 174.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' ' 44' ' ' ASP . 91.6 mt -65.6 -40.82 89.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 C-N-CA 123.593 0.757 . . . . 74.32 110.777 170.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 64' ' ' LEU . 76.0 mt -71.67 -30.65 65.95 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.746 0.418 . . . . 74.43 110.953 177.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -62.5 -20.41 64.58 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 112.803 0.668 . . . . 74.21 112.803 177.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 69.8 mtt180 -60.14 -44.95 94.55 Favored 'General case' 0 N--CA 1.5 2.043 0 CA-C-O 121.412 0.625 . . . . 71.25 110.748 174.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.5 p -78.07 -1.38 32.11 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-N 114.945 -1.025 . . . . 34.32 111.515 177.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 63.21 -118.23 13.31 Favored Glycine 0 C--N 1.355 1.606 0 N-CA-C 115.308 0.883 . . . . 74.52 115.308 177.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -69.85 -27.75 65.1 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.853 1.261 . . . . 75.22 110.264 -174.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 8.5 mmmm -55.81 -59.86 4.27 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 123.82 0.848 . . . . 73.31 111.208 170.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -62.81 -35.95 92.68 Favored Glycine 0 C--N 1.348 1.23 0 O-C-N 123.519 0.512 . . . . 61.24 113.253 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -54.33 -65.07 0.64 Allowed 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.754 0.822 . . . . 63.03 112.683 172.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.414 ' HA ' HD12 ' A' ' 80' ' ' LEU . 60.7 t -64.35 -32.36 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 C-N-CA 122.643 0.377 . . . . 52.11 111.847 -177.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.06 -42.94 99.82 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.047 0.539 . . . . 75.13 111.839 174.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -62.91 -44.12 96.94 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 123.049 0.54 . . . . 72.43 110.704 173.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' O ' ' HG2' ' A' ' 84' ' ' GLU . 86.9 mt -56.66 -47.98 78.58 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.913 0.485 . . . . 61.01 111.755 176.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -73.48 -31.57 63.83 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 113.459 0.911 . . . . 72.11 113.459 -176.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 92.0 p -65.37 -42.24 92.96 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.987 -0.746 . . . . 71.42 108.987 167.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 16.2 tp -66.2 -30.34 70.78 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 124.062 0.945 . . . . 75.23 111.476 178.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 80' ' ' LEU . 6.0 mm-40 -64.44 -36.94 85.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.242 0.617 . . . . 74.2 110.979 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.2 tt -76.23 -47.71 22.99 Favored 'General case' 0 CA--C 1.562 1.413 0 C-N-CA 123.694 0.798 . . . . 73.32 110.303 178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -88.12 -56.63 3.25 Favored 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.905 1.076 . . . . 74.13 113.905 -173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . 0.532 ' HB3' HD23 ' A' ' 90' ' ' LEU . 28.6 m-85 -133.99 76.91 63.51 Favored Pre-proline 0 N--CA 1.509 2.511 0 CA-C-N 119.294 0.952 . . . . 71.13 112.531 -177.492 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' PRO . . . . . 0.763 ' HB3' HH12 ' A' ' 101' ' ' ARG . 36.4 Cg_endo -64.41 -13.5 38.79 Favored 'Trans proline' 0 CA--C 1.566 2.08 0 C-N-CA 122.668 2.245 . . . . 73.31 114.829 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' HG3' HD22 ' A' ' 90' ' ' LEU . 10.5 pt20 -76.95 -33.77 57.67 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 118.418 0.554 . . . . 71.11 111.283 172.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 21' ' ' LEU . 4.2 mm? -66.3 -34.78 78.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.089 0.555 . . . . 71.42 110.204 172.693 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TYR . . . . . 0.511 ' O ' HG22 ' A' ' 95' ' ' THR . 90.7 t80 -66.05 -52.48 48.62 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 110.359 -0.237 . . . . 73.1 110.359 170.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LYS . . . . . 0.409 ' HE2' ' HD3' ' A' ' 99' ' ' PRO . 16.6 tppt? -44.42 -46.68 9.66 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 124.723 1.209 . . . . 71.32 112.224 177.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.436 ' HD2' HD13 ' A' ' 90' ' ' LEU . 17.6 ptpt -73.55 -45.83 51.16 Favored 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 112.87 0.692 . . . . 75.32 112.87 178.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.505 HG22 ' HA ' ' A' ' 91' ' ' TYR . 34.2 m -60.05 -41.2 85.55 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 N-CA-C 113.278 0.844 . . . . 74.02 113.278 -176.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 91' ' ' TYR . 9.1 t -94.92 -30.88 13.93 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 112.031 0.382 . . . . 62.14 112.031 -178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 85.97 21.33 53.17 Favored Glycine 0 N--CA 1.473 1.118 0 CA-C-N 116.418 -0.355 . . . . 42.33 112.526 -179.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.467 ' H ' HG23 ' A' ' 95' ' ' THR . 16.4 mtpp -140.1 169.28 17.99 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.513 1.125 . . . . 71.11 111.062 -169.875 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -60.87 145.6 88.45 Favored Pre-proline 0 CA--C 1.555 1.149 0 C-N-CA 124.006 0.922 . . . . 74.21 112.497 176.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . 0.5 ' HB3' ' NH1' ' A' ' 101' ' ' ARG . 86.3 Cg_exo -50.73 103.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.381 2.247 0 C-N-CA 123.104 2.536 . . . . 62.32 112.222 170.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.78 -39.61 51.01 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.443 0.697 . . . . 62.45 111.758 -169.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.763 HH12 ' HB3' ' A' ' 88' ' ' PRO . 30.0 mmt180 67.48 52.14 0.81 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 125.022 1.329 . . . . 71.13 110.629 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 2.8 t -85.44 49.63 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.352 0 C-N-CA 124.18 0.992 . . . . 74.43 110.121 -178.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . 0.438 ' O ' HG12 ' A' ' 107' ' ' ILE . 39.7 m-85 -54.98 -2.2 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 115.164 1.542 . . . . 74.41 115.164 -176.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . 0.457 ' HA ' ' HB ' ' A' ' 107' ' ' ILE . 32.5 t -59.05 -17.91 29.99 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 124.478 1.111 . . . . 62.55 112.117 179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 34.1 tpp -58.24 -63.28 1.32 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.598 0.759 . . . . 63.44 111.412 170.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.457 HD12 ' HB2' ' A' ' 115' ' ' LEU . 0.0 OUTLIER -70.11 -33.19 53.89 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.484 0 C-N-CA 123.365 0.666 . . . . 63.32 110.413 -178.132 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.481 HG23 ' HG3' ' A' ' 112' ' ' GLU . 46.7 mm -64.3 -41.1 91.33 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 C-N-CA 123.653 0.781 . . . . 74.15 111.383 176.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -70.03 -45.69 66.63 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.022 0.529 . . . . 70.11 111.816 173.08 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -64.17 -50.1 69.49 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 113.9 1.074 . . . . 75.42 113.9 -170.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.2 p -120.02 -13.51 8.99 Favored 'General case' 0 N--CA 1.501 2.112 0 C-N-CA 123.004 0.522 . . . . 33.21 112.389 -177.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 109.16 167.71 20.52 Favored Glycine 0 CA--C 1.531 1.076 0 N-CA-C 112.344 -0.303 . . . . 70.43 112.344 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.481 ' HG3' HG23 ' A' ' 107' ' ' ILE . 1.7 mp0 -59.55 -39.5 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 123.367 0.667 . . . . 75.44 110.319 173.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 62.9 p -60.2 -26.84 66.68 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.25 1.02 . . . . 73.22 112.717 175.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.9 -57.77 15.92 Favored Glycine 0 C--N 1.35 1.345 0 CA-C-N 117.944 0.338 . . . . 62.22 112.635 175.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.457 ' HB2' HD12 ' A' ' 106' ' ' ILE . 27.1 tp -64.04 -34.03 77.1 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.322 0.649 . . . . 73.44 111.477 176.12 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 95.9 m -57.77 -46.07 85.07 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.255 0.622 . . . . 73.24 110.739 172.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -64.07 -45.34 89.17 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.204 0.602 . . . . 74.11 111.58 176.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.39 -49.56 74.12 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 123.565 0.746 . . . . 61.11 112.471 178.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' B' ' 119' ' ' LEU . 80.0 mt -70.25 -48.1 58.36 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.725 0.81 . . . . 61.44 111.24 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.406 ' O ' HG22 ' A' ' 123' ' ' VAL . 8.2 tpt -52.59 -41.9 64.04 Favored 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 124.19 0.996 . . . . 72.11 112.895 176.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' THR . . . . . . . . . . . . . 14.6 t -75.71 -38.9 58.18 Favored 'General case' 0 N--CA 1.483 1.198 0 O-C-N 121.992 -0.443 . . . . 70.43 111.447 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -60.36 -37.06 79.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 123.255 0.622 . . . . 72.15 112.109 -178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.496 ' O ' ' HG2' ' A' ' 127' ' ' GLN . 14.5 m -63.61 -27.91 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 CA-C-O 119.622 -0.228 . . . . 74.53 111.043 177.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' MET . . . . . 0.426 ' HE2' ' HB2' ' A' ' 124' ' ' MET . 41.7 mtm -81.89 -37.04 27.48 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.335 0.654 . . . . 64.33 110.251 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 5.1 mtpm? -57.11 -34.77 68.68 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.9 0.88 . . . . 73.22 110.593 168.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.412 ' HB3' ' HB3' ' B' ' 126' ' ' LEU . 40.3 mt -80.73 -30.0 36.26 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.486 1.114 . . . . 73.25 111.549 175.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' GLN . . . . . 0.496 ' HG2' ' O ' ' A' ' 123' ' ' VAL . 29.0 mm-40 -60.8 -38.34 85.0 Favored 'General case' 0 N--CA 1.501 2.117 0 CA-C-N 118.574 0.625 . . . . 73.23 110.068 169.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm -72.15 -44.35 63.24 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.37 0.668 . . . . 44.41 111.188 176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LYS . . . . . 0.444 ' O ' ' HG ' ' A' ' 133' ' ' LEU . 54.4 tptt -58.7 -45.77 88.75 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.203 0.601 . . . . 73.31 111.775 177.535 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 42.5 t -63.72 -48.85 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 123.572 0.749 . . . . 62.11 111.122 179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLN . . . . . 0.545 ' HA ' HG22 ' A' ' 134' ' ' THR . 9.8 pt20 -66.19 -31.53 72.42 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 111.286 0.106 . . . . 73.41 111.286 -178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' A' ' 136' ' ' LEU . 17.5 t70 -62.63 -45.17 94.1 Favored 'General case' 0 C--N 1.357 0.91 0 C-N-CA 123.068 0.547 . . . . 54.32 110.461 176.011 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 129' ' ' LYS . 14.5 mt -73.66 -41.86 62.13 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.752 -0.658 . . . . 75.35 110.83 -175.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . 0.545 HG22 ' HA ' ' A' ' 131' ' ' GLN . 5.4 t -69.46 -29.43 67.11 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.62 0.368 . . . . 74.54 111.359 179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -68.67 -44.18 74.59 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.09 0.556 . . . . 42.54 111.528 174.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.547 ' HB2' HD11 ' B' ' 137' ' ' LEU . 51.5 mt -73.87 -25.12 59.88 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.931 0.493 . . . . 63.34 111.204 176.674 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' LEU . . . . . 0.507 HD11 ' HB2' ' B' ' 136' ' ' LEU . 0.8 OUTLIER -73.14 -42.08 63.24 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.738 0.815 . . . . 45.45 109.028 175.641 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 39.5 t -59.91 -35.26 74.5 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 124.694 1.197 . . . . 61.13 111.765 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 32.0 t -146.55 96.17 2.72 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.198 0.599 . . . . 74.34 110.014 177.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.445 ' HD3' ' HD2' ' B' ' 140' ' ' LYS . 9.2 mtpm? -84.88 169.14 14.41 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-O 121.605 0.717 . . . . 71.41 112.1 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -100.82 44.82 1.0 Allowed 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 114.947 -1.024 . . . . 62.43 109.644 179.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 22.3 t70 . . . . . 0 CA--C 1.566 1.594 0 C-N-CA 125.487 1.515 . . . . 73.44 111.605 -177.438 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.998 0 CA-C-O 119.851 -0.416 . . . . 64.41 113.159 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' SER . . . . . . . . . . . . . 23.0 t 72.52 4.45 5.0 Favored 'General case' 0 N--CA 1.502 2.163 0 C-N-CA 125.199 1.399 . . . . 74.14 113.516 173.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -102.43 -161.51 0.85 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.807 0.843 . . . . 72.11 111.085 -179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -77.74 -47.72 18.37 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.122 0.569 . . . . 75.11 111.984 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -111.01 88.68 2.84 Favored 'General case' 0 N--CA 1.479 1.006 0 CA-C-O 121.314 0.578 . . . . 72.3 110.635 -174.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -94.36 96.8 9.77 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 123.128 0.571 . . . . 64.42 109.676 -178.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -79.42 77.29 5.98 Favored 'General case' 0 N--CA 1.489 1.482 0 CA-C-O 122.085 0.945 . . . . 63.54 112.341 -173.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -81.94 -14.82 55.56 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.682 0.793 . . . . 72.04 111.66 171.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -51.74 -33.53 35.17 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.606 1.162 . . . . 73.53 113.043 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' CYS . . . . . . . . . . . . . 70.6 m -57.62 -37.86 73.99 Favored 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.163 0.985 . . . . 72.12 113.603 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -53.11 -20.69 3.98 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.31 1.226 . . . . 73.23 114.31 177.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 89.6 p -57.41 -33.6 68.03 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.803 0.841 . . . . 63.52 112.668 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 84.3 t -56.74 -42.93 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 C-N-CA 124.235 1.014 . . . . 75.23 110.92 172.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 95.0 mt -78.85 -31.04 45.49 Favored 'General case' 0 CA--C 1.555 1.156 0 CA-C-N 115.361 -0.836 . . . . 75.22 112.064 179.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -61.93 -40.6 96.06 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.362 0.665 . . . . 75.44 112.072 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . -54.55 -20.46 17.4 Favored Glycine 0 CA--C 1.543 1.798 0 N-CA-C 114.647 0.619 . . . . 65.25 114.647 171.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -125.66 20.65 7.83 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.469 0.708 . . . . 74.53 111.689 177.008 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.42 ' O ' HG23 ' B' ' 22' ' ' THR . 8.4 tpp85 -47.66 -51.59 21.13 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.122 0.969 . . . . 61.41 112.225 -179.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.11 -35.71 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.092 0.557 . . . . 75.42 112.224 -176.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' THR . . . . . . . . . . . . . 20.8 m -71.69 -41.3 68.79 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 122.714 0.406 . . . . 50.45 110.14 178.334 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.731 HD23 HD12 ' B' ' 90' ' ' LEU . 93.3 mt -58.39 -45.07 89.03 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.627 0.771 . . . . 75.42 110.175 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.566 HG22 ' HB ' ' B' ' 61' ' ' VAL . 57.9 p -70.08 -29.39 66.37 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 113.724 1.009 . . . . 74.33 113.724 -179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' SER . . . . . . . . . . . . . 57.0 m -77.85 -44.61 26.72 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.614 0.366 . . . . 62.53 111.865 178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' VAL . . . . . 0.506 HG11 HD21 ' B' ' 90' ' ' LEU . 50.0 t -84.39 -48.54 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 CA-C-N 115.962 -0.563 . . . . 51.11 112.46 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 27.8 mt -85.17 150.74 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 C-N-CA 123.325 0.65 . . . . 71.23 110.759 -172.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ASP . . . . . 0.454 ' HB2' ' NH2' ' B' ' 57' ' ' ARG . 3.7 t70 -131.42 119.79 17.63 Favored Pre-proline 0 C--O 1.252 1.185 0 N-CA-C 108.659 -0.867 . . . . 71.51 108.659 170.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.853 ' HD3' HG22 ' B' ' 61' ' ' VAL . 74.6 Cg_exo -54.0 -10.84 2.11 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 123.861 3.041 . . . . 75.24 115.746 -177.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 66.6 p -64.32 -37.62 88.13 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 118.09 0.404 . . . . 60.45 110.943 176.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -82.45 -38.27 24.22 Favored 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 112.103 0.408 . . . . 72.33 112.103 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ILE . . . . . 0.691 HG12 ' HA ' ' B' ' 27' ' ' PRO . 24.2 pt -83.95 -23.74 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 CA-C-O 119.051 -0.5 . . . . 71.22 111.775 -173.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' THR . . . . . 0.411 ' HA ' HD13 ' B' ' 40' ' ' LEU . 2.3 m -49.8 -53.85 37.91 Favored Pre-proline 0 N--CA 1.5 2.047 0 N-CA-C 114.231 1.197 . . . . 74.42 114.231 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -62.15 -30.28 81.94 Favored 'Trans proline' 0 C--N 1.387 2.586 0 C-N-CA 121.695 1.597 . . . . 72.33 112.899 -176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' TYR . . . . . 0.433 ' CE1' ' HG3' ' B' ' 81' ' ' GLU . 0.4 OUTLIER -71.88 -47.39 53.1 Favored 'General case' 0 CA--C 1.564 1.484 0 C-N-CA 123.54 0.736 . . . . 74.21 109.975 175.053 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.543 HD13 HD11 ' B' ' 68' ' ' LEU . 93.4 mt -61.66 -28.43 69.39 Favored 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.326 1.05 . . . . 71.5 112.172 177.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 26.2 mmm-85 -63.72 -50.85 67.5 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.124 0.97 . . . . 61.54 110.656 171.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -69.1 -20.15 64.06 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.071 0.549 . . . . 70.3 112.113 177.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' CYS . . . . . . . . . . . . . 83.6 m -83.59 -9.45 58.9 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.731 0.813 . . . . 60.21 111.226 170.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' LYS . . . . . 0.453 ' HG2' ' HB1' ' B' ' 109' ' ' ALA . 75.2 mmtt 70.7 12.03 7.23 Favored 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 125.465 1.506 . . . . 61.23 113.749 171.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 21.6 m -93.4 -34.38 5.8 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 C-N-CA 122.985 0.514 . . . . 74.21 111.552 -179.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' LEU . . . . . 0.563 HD21 ' HB3' ' B' ' 45' ' ' GLU . 9.5 tt -94.03 130.26 40.24 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.794 0.838 . . . . 71.24 109.476 174.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -104.74 158.92 30.97 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 123.878 0.871 . . . . 70.21 110.279 178.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -54.91 -20.29 22.26 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.498 2.799 . . . . 51.55 114.888 -176.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -73.63 -47.18 42.08 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 123.572 0.749 . . . . 75.15 111.124 176.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -61.35 -34.58 75.52 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 114.931 -1.031 . . . . 54.02 112.286 -174.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.563 ' HB3' HD21 ' B' ' 40' ' ' LEU . 8.1 pt-20 -76.59 -31.7 57.65 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-N 116.35 -0.387 . . . . 70.22 111.196 -179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -72.19 -36.98 69.36 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.018 0.527 . . . . 73.52 111.174 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -79.04 -38.07 37.42 Favored 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 112.355 0.502 . . . . 75.33 112.355 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 75.7 t -71.71 -49.82 43.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 CA-C-N 118.406 0.548 . . . . 70.14 111.076 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -89.21 24.43 2.17 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 122.953 0.501 . . . . 70.42 111.929 176.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 32.1 t -60.41 -33.22 72.19 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.429 0.633 . . . . 73.21 110.308 167.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' ASP . . . . . 0.484 ' HB3' HD21 ' B' ' 53' ' ' ASN . 11.4 m-20 -121.35 93.14 48.8 Favored Pre-proline 0 CA--C 1.561 1.391 0 C-N-CA 124.189 0.995 . . . . 71.51 109.13 169.654 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . . . . . . . . . 22.9 Cg_exo -66.77 -10.57 28.69 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 123.255 2.636 . . . . 74.43 114.849 -178.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.484 HD21 ' HB3' ' B' ' 51' ' ' ASP . 9.2 p30 -68.83 153.84 43.06 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.677 0.791 . . . . 61.14 112.488 -177.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' LEU . . . . . 0.637 ' H ' HD23 ' B' ' 54' ' ' LEU . 2.0 pt? -87.5 5.59 38.35 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.105 0.562 . . . . 71.35 111.631 178.554 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 26.3 t -73.81 -35.9 44.51 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.262 0 C-N-CA 123.333 0.653 . . . . 75.11 110.93 -179.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' ILE . . . . . . . . . . . . . 2.6 pp -104.61 21.72 3.11 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 123.8 0.84 . . . . 64.42 111.979 174.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.454 ' NH2' ' HB2' ' B' ' 26' ' ' ASP . 33.5 ttt180 -60.07 -29.09 68.33 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 124.011 0.924 . . . . 63.2 112.969 -170.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' LYS . . . . . 0.519 ' HA ' ' HB ' ' B' ' 22' ' ' THR . 45.9 mmtm -59.33 -45.48 91.22 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.683 0.793 . . . . 72.25 112.093 176.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -82.85 -26.01 32.06 Favored 'General case' 0 N--CA 1.481 1.118 0 CA-C-O 119.077 -0.487 . . . . 50.24 111.331 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.428 ' HD2' ' HD2' ' B' ' 27' ' ' PRO . 37.0 ttmt -61.21 -52.82 63.19 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 118.35 0.523 . . . . 73.44 112.147 -176.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.853 HG22 ' HD3' ' B' ' 27' ' ' PRO . 5.1 t -78.03 -29.76 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.316 0 CA-C-N 116.349 -0.387 . . . . 64.31 110.06 178.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' GLY . . . . . . . . . . . . . . . -61.46 -47.39 90.95 Favored Glycine 0 C--N 1.354 1.578 0 CA-C-N 115.575 -0.739 . . . . 73.31 113.148 178.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 35.0 m -68.14 -38.28 79.45 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.939 0 N-CA-C 109.847 -0.427 . . . . 74.11 109.847 177.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -53.63 -41.05 66.31 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 124.399 1.08 . . . . 71.32 111.768 177.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.408 HD12 ' NE ' ' B' ' 18' ' ' ARG . 15.2 mt -66.82 -51.78 51.6 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 120.881 0.372 . . . . 54.2 111.374 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.83 -22.28 66.84 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.723 0.809 . . . . 72.41 112.106 177.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' ILE . . . . . . . . . . . . . 22.9 mt -76.75 -57.94 5.17 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.872 0 C-N-CA 123.875 0.87 . . . . 64.02 110.241 175.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 0.543 HD11 HD13 ' B' ' 34' ' ' LEU . 75.7 mt -60.89 -20.0 61.25 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 112.718 0.636 . . . . 60.31 112.718 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -48.38 -26.98 2.32 Favored 'General case' 0 CA--C 1.575 1.917 0 C-N-CA 123.651 0.781 . . . . 73.42 112.85 167.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' ARG . . . . . 0.566 ' HG3' HG23 ' B' ' 71' ' ' THR . 16.7 ptm180 -52.83 -28.77 24.26 Favored 'General case' 0 N--CA 1.503 2.199 0 C-N-CA 124.938 1.295 . . . . 74.51 112.908 176.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.566 HG23 ' HG3' ' B' ' 70' ' ' ARG . 72.9 p -104.06 -2.4 26.0 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.819 0.848 . . . . 74.33 111.78 -178.248 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLY . . . . . . . . . . . . . . . 69.53 -120.49 10.15 Favored Glycine 0 C--N 1.352 1.432 0 N-CA-C 114.706 0.643 . . . . 31.24 114.706 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' HIS . . . . . . . . . . . . . 19.3 t60 -68.35 -30.87 69.92 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 125.118 1.367 . . . . 73.1 110.664 -178.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' LYS . . . . . . . . . . . . . 7.9 mmmm -49.82 -60.64 2.72 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.722 0.809 . . . . 60.23 111.297 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.34 -38.88 93.99 Favored Glycine 0 N--CA 1.474 1.22 0 O-C-N 123.773 0.671 . . . . 75.03 113.927 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -56.68 -61.94 2.08 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.558 0.743 . . . . 73.04 111.73 175.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' VAL . . . . . . . . . . . . . 78.3 t -63.23 -30.37 49.57 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.273 0.629 . . . . 54.22 111.241 -178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -70.82 -37.74 73.23 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.26 0.624 . . . . 73.2 112.282 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' PHE . . . . . . . . . . . . . 83.8 t80 -65.44 -41.63 93.25 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 109.655 -0.498 . . . . 74.22 109.655 174.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . 0.428 ' O ' ' HG3' ' B' ' 84' ' ' GLU . 68.1 mt -64.12 -41.0 97.39 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 123.648 0.593 . . . . 64.53 110.857 174.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' GLU . . . . . 0.433 ' HG3' ' CE1' ' B' ' 33' ' ' TYR . 7.1 tp10 -55.9 -51.71 66.64 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 125.803 1.641 . . . . 75.12 111.443 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 80.8 p -65.46 -43.89 88.93 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 115.115 -0.948 . . . . 61.32 111.251 171.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 23.1 tp -61.91 -37.84 86.15 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 113.014 0.746 . . . . 62.3 113.014 -173.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' B' ' 80' ' ' LEU . 31.0 mt-10 -62.8 -30.52 71.53 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.736 0.414 . . . . 71.33 111.26 -179.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.624 HD21 ' HG2' ' B' ' 122' ' ' GLU . 9.2 tt -79.33 -55.24 5.22 Favored 'General case' 0 CA--C 1.557 1.216 0 C-N-CA 123.311 0.644 . . . . 71.22 110.358 175.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -76.79 -49.89 14.79 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.838 1.051 . . . . 73.25 113.838 -171.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' TYR . . . . . . . . . . . . . 87.4 m-85 -134.82 79.32 52.52 Favored Pre-proline 0 N--CA 1.495 1.803 0 C-N-CA 123.007 0.523 . . . . 64.1 111.112 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -63.22 -18.32 64.32 Favored 'Trans proline' 0 CA--C 1.563 1.946 0 C-N-CA 122.762 2.308 . . . . 74.21 113.925 177.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.52 -33.81 62.87 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 123.398 0.679 . . . . 71.13 111.857 171.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' LEU . . . . . 0.731 HD12 HD23 ' B' ' 21' ' ' LEU . 3.4 mm? -71.31 -34.94 71.05 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.19 0.596 . . . . 52.22 110.09 175.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.403 ' HE2' ' HA ' ' B' ' 99' ' ' PRO . 67.8 t80 -67.61 -47.16 70.47 Favored 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 120.933 0.397 . . . . 74.4 110.622 171.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -49.75 -49.05 49.74 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.616 1.166 . . . . 72.55 112.781 174.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' LYS . . . . . 0.453 ' HD2' HD13 ' B' ' 90' ' ' LEU . 0.4 OUTLIER -72.75 -38.11 67.49 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 112.597 0.592 . . . . 65.4 112.597 -177.527 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 26.4 m -69.16 -37.8 77.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 CA-C-N 118.732 0.696 . . . . 54.4 112.155 179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' THR . . . . . . . . . . . . . 82.3 p -85.6 -45.93 11.27 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 112.053 0.39 . . . . 55.34 112.053 -177.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . 90.84 2.51 71.93 Favored Glycine 0 CA--C 1.541 1.658 0 CA-C-N 116.093 -0.503 . . . . 15.41 114.125 -174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -174.88 4.05 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.186 0.594 . . . . 73.23 111.997 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -57.65 155.94 19.35 Favored Pre-proline 0 N--CA 1.488 1.463 0 C-N-CA 124.728 1.211 . . . . 72.23 113.074 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 99' ' ' PRO . . . . . 0.403 ' HA ' ' HE2' ' B' ' 91' ' ' TYR . 52.0 Cg_exo -54.97 120.16 7.7 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.602 2.202 . . . . 64.31 112.654 172.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.44 -41.57 72.69 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.76 0.424 . . . . 42.12 110.833 178.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 101' ' ' ARG . . . . . . . . . . . . . 67.1 mtm180 70.5 51.82 0.34 Allowed 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.606 -1.179 . . . . 72.11 109.697 173.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 102' ' ' VAL . . . . . . . . . . . . . 3.6 t -78.01 48.59 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.529 0 C-N-CA 124.68 1.192 . . . . 70.14 111.769 -177.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 103' ' ' PHE . . . . . 0.512 ' O ' HG12 ' B' ' 107' ' ' ILE . 92.8 m-85 -57.33 -7.81 0.64 Allowed 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 114.267 1.21 . . . . 71.32 114.267 179.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 104' ' ' SER . . . . . . . . . . . . . 37.9 t -58.83 -27.45 65.11 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.003 0.921 . . . . 75.01 111.917 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 35.5 tpp -58.33 -63.06 1.4 Allowed 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.454 0.702 . . . . 74.23 111.336 175.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ILE . . . . . 0.516 HD12 ' HB2' ' B' ' 115' ' ' LEU . 0.0 OUTLIER -69.97 -32.0 49.93 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.38 0 C-N-CA 122.822 0.449 . . . . 62.44 111.321 -177.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ILE . . . . . 0.512 HG12 ' O ' ' B' ' 103' ' ' PHE . 49.6 mm -64.97 -37.91 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 122.536 0.334 . . . . 65.34 111.32 175.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -75.78 -38.99 57.8 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.678 0.391 . . . . 64.34 111.624 175.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' ALA . . . . . 0.453 ' HB1' ' HG2' ' B' ' 38' ' ' LYS . . . -74.38 -62.65 1.45 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.346 0.658 . . . . 65.31 112.408 -174.074 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 43.4 t -94.3 -40.27 10.06 Favored 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 123.118 0.567 . . . . 72.41 112.066 178.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' GLY . . . . . . . . . . . . . . . 118.86 167.4 13.82 Favored Glycine 0 N--CA 1.474 1.187 0 CA-C-N 116.441 -0.345 . . . . 30.43 113.023 -172.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -61.14 -41.7 97.21 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.413 0.685 . . . . 51.55 111.846 176.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 69.5 m -64.15 -34.97 79.27 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.559 0.744 . . . . 54.41 111.867 177.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 114' ' ' GLY . . . . . . . . . . . . . . . -61.54 -49.55 75.68 Favored Glycine 0 C--N 1.349 1.295 0 O-C-N 123.144 0.277 . . . . 73.1 112.651 175.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 115' ' ' LEU . . . . . 0.516 ' HB2' HD12 ' B' ' 106' ' ' ILE . 41.8 tp -64.36 -40.35 95.68 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.124 0.57 . . . . 74.52 111.495 175.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 53.4 m -56.79 -41.84 78.43 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.726 0.811 . . . . 73.05 110.763 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 117' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -68.85 -41.02 79.05 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.26 0.624 . . . . 72.04 112.171 176.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 118' ' ' LEU . . . . . . . . . . . . . 94.7 mt -59.63 -42.79 93.5 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 123.254 0.621 . . . . 60.3 111.693 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.659 ' HB3' ' HB3' ' A' ' 119' ' ' LEU . 86.3 mt -73.09 -43.32 61.96 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.966 0.906 . . . . 74.35 111.485 179.162 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 120' ' ' MET . . . . . . . . . . . . . 9.4 tpt -61.13 -37.51 83.07 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 124.253 1.021 . . . . 74.41 111.846 178.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 121' ' ' THR . . . . . . . . . . . . . 14.3 t -77.23 -37.06 54.07 Favored 'General case' 0 N--CA 1.476 0.835 0 O-C-N 122.256 -0.278 . . . . 70.51 111.433 173.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.624 ' HG2' HD21 ' B' ' 85' ' ' LEU . 14.9 tp10 -58.86 -39.37 81.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.065 0.546 . . . . 73.43 112.035 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 123' ' ' VAL . . . . . 0.48 ' O ' ' HG2' ' B' ' 127' ' ' GLN . 13.0 m -64.44 -27.16 42.0 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.097 0 CA-C-O 119.245 -0.407 . . . . 73.42 111.299 176.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 124' ' ' MET . . . . . 0.437 ' O ' ' HG2' ' B' ' 128' ' ' LYS . 66.4 mtm -78.64 -38.92 38.44 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 122.975 0.51 . . . . 65.32 110.019 178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 125' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' B' ' 122' ' ' GLU . 45.3 mtpt -54.41 -41.53 69.42 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.474 1.11 . . . . 73.04 111.232 169.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 126' ' ' LEU . . . . . 0.418 ' O ' HG23 ' B' ' 130' ' ' VAL . 40.3 mt -78.49 -29.75 46.86 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.539 -1.209 . . . . 53.42 111.593 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 127' ' ' GLN . . . . . 0.48 ' HG2' ' O ' ' B' ' 123' ' ' VAL . 27.6 mm-40 -63.57 -34.62 78.21 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-N 118.433 0.561 . . . . 62.14 110.486 169.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 128' ' ' LYS . . . . . 0.437 ' HG2' ' O ' ' B' ' 124' ' ' MET . 46.5 mmtm -71.92 -44.22 64.03 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.022 0.529 . . . . 74.31 110.834 175.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 129' ' ' LYS . . . . . 0.524 ' O ' ' HG ' ' B' ' 133' ' ' LEU . 54.7 tptt -62.45 -47.15 85.31 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 122.727 0.411 . . . . 42.42 111.57 178.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 130' ' ' VAL . . . . . 0.418 HG23 ' O ' ' B' ' 126' ' ' LEU . 51.0 t -57.33 -48.59 82.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.243 0 C-N-CA 123.897 0.879 . . . . 72.34 111.419 176.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 131' ' ' GLN . . . . . 0.592 ' HA ' HG22 ' B' ' 134' ' ' THR . 8.3 pt20 -68.74 -30.45 69.07 Favored 'General case' 0 N--CA 1.484 1.238 0 N-CA-C 111.486 0.18 . . . . 70.51 111.486 -178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.15 -40.0 93.75 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 123.771 0.828 . . . . 72.22 110.557 177.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 133' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 129' ' ' LYS . 29.5 mt -79.66 -40.54 28.9 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.439 -0.8 . . . . 71.32 110.822 -176.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 134' ' ' THR . . . . . 0.592 HG22 ' HA ' ' B' ' 131' ' ' GLN . 7.4 t -69.37 -29.33 67.08 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 111.484 0.179 . . . . 62.33 111.484 178.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.56 82.51 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.345 0.658 . . . . 74.32 112.207 173.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 136' ' ' LEU . . . . . 0.507 ' HB2' HD11 ' A' ' 137' ' ' LEU . 29.9 mt -80.77 -40.24 25.46 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.873 0.869 . . . . 71.32 110.233 179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 137' ' ' LEU . . . . . 0.547 HD11 ' HB2' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -59.77 -26.01 65.36 Favored 'General case' 0 CA--C 1.568 1.66 0 C-N-CA 124.807 1.243 . . . . 72.41 111.691 171.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 138' ' ' SER . . . . . . . . . . . . . 47.2 t -83.78 -43.39 15.48 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.543 0.737 . . . . 74.12 111.345 176.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 139' ' ' SER . . . . . . . . . . . . . 46.5 t -149.43 111.75 4.69 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.677 0.791 . . . . 70.11 109.531 178.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 140' ' ' LYS . . . . . 0.445 ' HD2' ' HD3' ' A' ' 140' ' ' LYS . 40.4 mtpt -77.58 165.81 23.83 Favored 'General case' 0 N--CA 1.48 1.034 0 CA-C-O 122.441 1.115 . . . . 71.24 113.775 -175.229 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -113.31 -36.23 5.07 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 113.476 -1.693 . . . . 51.42 109.125 171.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 142' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.562 1.42 0 C-N-CA 124.024 0.93 . . . . 72.2 110.654 174.207 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_