data_6trp_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 6trp _Structure_validation_residue.Date_analyzed 2020-08-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.433 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp . . . . . 0 C--O 1.235 0.318 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.433 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HZ3' HD21 ' A' 3304 ' ' LEU . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt . . . . . 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3304 ' ' LEU . . . . . 0.43 HD21 ' HZ3' ' A' ' 19' ' ' LYS . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--O 1.233 0.227 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t . . . . . 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 110.464 -0.198 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3301 ' ' GLN . . . . . 0.423 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt . . . . . 0 C--O 1.238 0.497 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3301 ' ' GLN . . . . . 0.419 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.167 0.508 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3301 ' ' GLN . . . . . 0.409 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.44 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp . . . . . 0 N--CA 1.444 -0.754 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.44 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.448 -0.54 0 CA-C-O 123.405 1.574 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp . . . . . 0 C--O 1.231 0.08 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 C--O 1.236 0.384 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3295 ' ' GLN . . . . . 0.5 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . 0.451 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp . . . . . 0 N--CA 1.469 0.483 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 122.025 0.917 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 tt . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.544 0.211 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.528 0.116 0 CA-C-O 120.998 0.428 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.821 0.343 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HE2' HD22 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3304 ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp . . . . . 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -61.97 146.19 50.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.433 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp -39.91 151.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 127.817 2.447 . . . . 0.0 115.375 -178.352 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.433 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.43 ' HZ3' HD21 ' A' 3304 ' ' LEU . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 51.29 19.78 0.82 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -125.66 -177.0 3.76 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.368 2.267 . . . . 0.0 111.35 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 m -127.32 -64.11 1.01 Allowed 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 126.337 1.855 . . . . 0.0 108.19 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.1 t -124.5 33.19 5.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.812 1.245 . . . . 0.0 111.499 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 58.43 34.75 24.23 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.99 -1.069 . . . . 0.0 112.777 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 168.36 2.25 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.386 1.075 . . . . 0.0 112.481 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -84.39 -69.48 0.64 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.17 -133.69 11.54 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 106.818 -2.513 . . . . 0.0 106.818 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 24.6 m -160.28 -30.17 0.06 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.357 1.079 . . . . 0.0 112.891 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.06 -176.52 16.94 Favored Glycine 0 CA--C 1.537 1.426 0 CA-C-N 119.924 1.238 . . . . 0.0 113.807 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 p -137.38 -179.22 5.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.239 2.216 . . . . 0.0 110.28 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 -164.59 10.66 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 126.381 1.944 . . . . 0.0 109.724 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.8 p -144.48 176.04 9.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.059 0.929 . . . . 0.0 112.322 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.49 24.41 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.033 1.778 . . . . 0.0 109.899 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 p -151.23 -173.87 4.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.737 1.215 . . . . 0.0 109.584 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -144.12 161.43 27.87 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -75.22 -45.42 40.45 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.887 1.275 . . . . 0.0 113.674 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.31 -165.07 52.9 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 -178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.1 p -155.38 157.59 37.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.829 0.852 . . . . 0.0 108.824 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.0 -155.47 38.69 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 t -154.82 163.31 40.46 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 159.12 -175.69 36.03 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.3 m -79.56 144.53 33.8 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -147.84 112.51 0.59 Allowed Glycine 0 C--N 1.332 0.318 0 N-CA-C 107.398 -2.281 . . . . 0.0 107.398 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 p -164.07 177.48 8.41 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.332 1.053 . . . . 0.0 108.706 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.51 162.5 33.54 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 125.814 1.674 . . . . 0.0 109.319 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 t -168.54 158.58 9.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.92 1.688 . . . . 0.0 106.7 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.37 154.69 25.7 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.204 1.383 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.6 p -162.43 179.82 7.52 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.708 0.803 . . . . 0.0 110.727 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.52 157.75 8.88 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 124.358 0.98 . . . . 0.0 112.698 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m -158.56 146.84 18.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.525 2.33 . . . . 0.0 106.139 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.1 -153.49 7.02 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -77.8 -137.07 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -66.51 159.71 26.66 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.577 -1.327 . . . . 0.0 110.205 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt -98.44 99.66 9.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3304 ' ' LEU . . . . . 0.43 HD21 ' HZ3' ' A' ' 19' ' ' LYS . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 65.74 30.23 76.83 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.2 135.04 54.12 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 126.049 1.74 . . . . 0.0 110.855 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -86.63 99.11 11.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.267 0.627 . . . . 0.0 110.845 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.906 1.682 . . . . 0.0 107.746 177.069 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 CA--C 1.508 -0.662 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.94 147.44 34.16 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp -62.38 145.55 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t 56.61 20.24 4.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 pp -134.76 177.13 8.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.904 1.681 . . . . 0.0 109.883 -179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 62.3 m -118.68 -48.07 2.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.558 1.143 . . . . 0.0 114.041 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.45 HG23 ' HE2' ' A' ' 32' ' ' LYS . 12.6 t -141.07 30.34 1.81 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.996 0.816 . . . . 0.0 110.966 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.256 14.5 mt-10 66.11 34.63 6.7 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 122.338 1.066 . . . . 0.0 110.844 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.45 ' HE2' HG23 ' A' ' 30' ' ' THR . 15.3 mtmt -72.42 163.3 28.22 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -128.32 -68.12 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 96.54 -118.61 6.06 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.1 t -151.96 -99.81 0.06 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 77.59 82.89 0.57 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -137.85 18.53 2.85 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.323 1.449 . . . . 0.0 111.558 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -102.26 -97.73 2.37 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 t 57.48 -1.16 0.07 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.754 2.021 . . . . 0.0 115.946 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -102.79 43.33 1.7 Allowed Glycine 0 CA--C 1.524 0.622 0 CA-C-N 120.474 1.488 . . . . 0.0 111.06 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.2 m -156.84 172.12 19.2 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.697 1.199 . . . . 0.0 109.092 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -68.79 130.5 25.35 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 108.462 -1.855 . . . . 0.0 108.462 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.2 p -59.55 152.0 23.07 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.226 0.513 . . . . 0.0 109.784 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.85 36.69 0.9 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.263 1.411 . . . . 0.0 110.409 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.4 m -66.75 173.48 3.49 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.173 1.789 . . . . 0.0 111.409 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -153.49 150.57 22.29 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.1 m -89.08 -175.37 4.79 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.082 1.353 . . . . 0.0 112.269 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.69 -169.39 13.61 Favored Glycine 0 CA--C 1.531 1.077 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.6 t -167.0 134.87 2.56 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.839 1.319 . . . . 0.0 112.92 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.98 16.84 27.67 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.167 1.365 . . . . 0.0 110.522 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.0 p 51.84 24.29 2.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.068 2.547 . . . . 0.0 114.911 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -121.13 172.93 15.38 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 125.723 1.63 . . . . 0.0 110.441 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.1 t -153.97 101.38 2.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.1 177.42 32.34 Favored Glycine 0 CA--C 1.521 0.441 0 O-C-N 121.721 -0.612 . . . . 0.0 111.934 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.1 m -144.82 174.17 11.22 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.752 1.621 . . . . 0.0 108.736 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.45 160.14 27.85 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.1 m -139.86 177.69 7.78 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.384 1.074 . . . . 0.0 109.864 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 121.49 -136.47 11.13 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -84.32 5.07 28.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.256 1.028 . . . . 0.0 111.807 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -81.54 149.48 28.65 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt -74.55 101.79 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 64.18 40.16 97.77 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.34 176.75 7.19 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.841 1.256 . . . . 0.0 111.35 -178.149 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -90.29 14.77 11.86 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.336 1.855 . . . . 0.0 113.691 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.992 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 mmt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -62.43 129.85 42.55 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.165 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt -65.42 140.73 19.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t 52.8 20.5 1.62 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 pp -124.92 175.15 7.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.918 1.687 . . . . 0.0 110.377 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.9 m -112.86 -45.15 3.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 113.321 -1.763 . . . . 0.0 111.564 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -162.94 43.11 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.15 28.69 16.04 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.875 -1.141 . . . . 0.0 109.066 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.73 106.84 5.65 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 103.844 -2.65 . . . . 0.0 103.844 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.4 172.56 6.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 123.003 0.521 . . . . 0.0 111.747 -178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 160.75 153.63 7.05 Favored Glycine 0 CA--C 1.525 0.684 0 C-N-CA 124.751 1.167 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.6 m -142.46 173.21 11.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.262 1.425 . . . . 0.0 109.239 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.24 178.6 48.6 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 p -139.4 169.13 18.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.606 1.162 . . . . 0.0 111.204 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.05 146.58 16.13 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 109.101 -1.599 . . . . 0.0 109.101 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -128.36 174.97 8.86 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.483 1.513 . . . . 0.0 109.119 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -158.68 179.67 34.17 Favored Glycine 0 CA--C 1.521 0.452 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.8 m -155.98 154.79 31.66 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.559 -0.965 . . . . 0.0 109.461 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.24 169.76 52.81 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -156.63 161.44 39.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.62 101.09 0.16 Allowed Glycine 0 C--O 1.226 -0.345 0 N-CA-C 108.371 -1.892 . . . . 0.0 108.371 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.3 t -165.98 -177.27 4.14 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.151 1.78 . . . . 0.0 106.772 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.65 -170.62 54.87 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 m -149.72 -12.45 0.28 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.36 38.69 0.26 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 119.514 1.052 . . . . 0.0 111.541 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.2 m -58.44 -20.18 42.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.951 1.701 . . . . 0.0 115.351 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.78 179.63 51.69 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-N 119.517 1.053 . . . . 0.0 110.539 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.2 p -142.57 174.85 10.27 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.279 1.831 . . . . 0.0 109.187 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.73 167.48 28.17 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.2 m -121.58 -13.64 8.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 79.17 -173.42 55.3 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -136.14 -160.47 1.06 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.588 1.155 . . . . 0.0 110.491 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.75 88.63 1.94 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.3 t -131.66 -27.0 1.96 Allowed 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.79 1.034 . . . . 0.0 113.79 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.07 -71.34 0.03 OUTLIER Glycine 0 C--N 1.335 0.481 0 N-CA-C 110.337 -1.105 . . . . 0.0 110.337 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -68.15 -178.69 1.09 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.017 0.909 . . . . 0.0 110.574 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -54.74 161.05 1.66 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 123.548 0.739 . . . . 0.0 112.146 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt -109.13 90.56 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 114.07 -45.19 1.35 Allowed Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.16 167.65 29.23 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 119.276 1.538 . . . . 0.0 112.817 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -163.96 87.26 0.5 Allowed 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 126.736 2.014 . . . . 0.0 108.107 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.85 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.011 -0.995 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -60.35 100.63 0.1 Allowed 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.35 137.68 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 125.674 1.59 . . . . 0.0 109.589 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.529 ' C ' ' H ' ' A' ' 28' ' ' LEU . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t 70.35 -33.2 0.26 Allowed 'General case' 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -73.75 180.0 3.92 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 128.383 2.673 . . . . 0.0 111.505 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.0 m -132.14 -26.86 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -165.29 29.71 0.06 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.043 0.937 . . . . 0.0 108.509 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 58.84 27.18 15.76 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.44 1.096 . . . . 0.0 112.436 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.11 38.78 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.225 2.61 . . . . 0.0 115.558 -178.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -64.61 -74.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.395 1.452 . . . . 0.0 110.591 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.09 -44.44 2.62 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.995 1.284 . . . . 0.0 114.5 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.7 p -145.82 -176.88 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.811 1.306 . . . . 0.0 111.009 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -172.14 171.93 44.49 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.911 1.72 . . . . 0.0 109.379 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.6 p -156.51 177.14 11.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.762 1.625 . . . . 0.0 110.162 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.95 -172.93 19.79 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.364 0.983 . . . . 0.0 113.551 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.4 t -81.68 -115.37 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.84 2.456 . . . . 0.0 109.359 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -168.24 166.15 39.3 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 127.127 2.299 . . . . 0.0 108.196 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.1 t -71.75 -30.48 65.63 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.61 -171.43 29.9 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -178.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.5 t -168.65 170.98 9.08 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.503 1.921 . . . . 0.0 106.693 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 162.99 171.25 28.99 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.5 p -162.91 174.71 12.02 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.578 1.151 . . . . 0.0 108.79 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.77 166.03 10.87 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 t -77.74 0.39 23.78 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.26 82.49 0.25 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.587 -1.805 . . . . 0.0 108.587 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 t -69.11 -2.68 10.83 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.47 -178.53 10.77 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.625 1.107 . . . . 0.0 111.454 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.8 p -152.15 173.98 14.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.059 0.944 . . . . 0.0 108.491 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.77 155.89 16.41 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.001 -2.44 . . . . 0.0 107.001 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.3 m -164.57 169.29 17.24 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.09 0.956 . . . . 0.0 109.124 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.46 132.74 2.65 Favored Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -164.23 150.19 10.85 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.301 1.84 . . . . 0.0 108.081 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.66 165.16 18.0 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 123.879 0.752 . . . . 0.0 111.313 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 t -148.29 -96.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.35 -65.67 0.27 Allowed Glycine 0 C--N 1.334 0.44 0 N-CA-C 108.151 -1.98 . . . . 0.0 108.151 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -71.1 -178.73 2.08 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.527 0.664 . . . . 0.0 110.636 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -57.62 162.32 3.09 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.337 0.589 . . . . 0.0 110.18 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt -92.96 98.28 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 72.4 53.47 8.75 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.59 -149.5 0.3 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.491 1.116 . . . . 0.0 111.595 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -141.43 27.01 1.92 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.784 2.033 . . . . 0.0 111.999 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 115.715 -2.088 . . . . 0.0 108.709 178.793 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 118.09 -0.957 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -76.62 119.92 21.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt -52.52 132.51 14.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 C-N-CA 124.501 1.12 . . . . 0.0 110.464 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.21 2.0 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.61 -170.84 1.92 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.446 2.298 . . . . 0.0 111.474 -179.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.7 m -131.9 -51.34 0.97 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 127.919 2.488 . . . . 0.0 107.504 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -150.91 37.83 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.965 1.306 . . . . 0.0 108.608 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 66.2 13.0 8.93 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.797 1.639 . . . . 0.0 113.733 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.96 -74.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.879 2.072 . . . . 0.0 115.39 -178.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -164.02 173.61 12.36 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.788 0.722 . . . . 0.0 109.392 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.23 -177.72 16.07 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.325 2.393 . . . . 0.0 108.788 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.7 t -165.22 160.91 18.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.111 1.456 . . . . 0.0 109.058 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.41 179.87 32.84 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.503 2.001 . . . . 0.0 109.657 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.29 169.13 16.23 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.758 1.223 . . . . 0.0 108.408 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.15 164.58 24.79 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -105.16 -130.5 0.28 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.736 1.268 . . . . 0.0 111.439 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 162.49 -107.92 0.33 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 107.854 -2.098 . . . . 0.0 107.854 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.7 p 56.0 7.69 0.31 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.248 1.819 . . . . 0.0 115.901 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.57 140.35 44.46 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.8 t -158.14 179.83 8.8 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.529 1.132 . . . . 0.0 108.262 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.02 162.88 33.62 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 108.903 -1.679 . . . . 0.0 108.903 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.6 m -158.18 79.57 0.83 Allowed 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.93 -36.94 0.9 Allowed Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.864 1.221 . . . . 0.0 113.704 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -73.36 178.32 4.64 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.372 1.469 . . . . 0.0 110.12 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -79.36 -148.45 4.57 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 125.235 1.398 . . . . 0.0 110.516 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 t -138.3 176.89 8.3 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.675 0.79 . . . . 0.0 109.628 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.47 171.76 42.75 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.9 t -159.87 -179.59 7.96 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.105 1.762 . . . . 0.0 106.269 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.09 152.07 10.23 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.044 -1.623 . . . . 0.0 109.044 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 t -150.82 -174.23 4.72 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.807 1.243 . . . . 0.0 108.843 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.82 178.08 34.49 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.9 t -162.66 -174.68 4.07 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.327 1.451 . . . . 0.0 107.8 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.73 174.44 35.11 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 126.747 2.118 . . . . 0.0 108.501 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -165.8 173.51 10.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.388 1.475 . . . . 0.0 108.644 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.34 -137.31 7.76 Favored Glycine 0 C--O 1.239 0.43 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -63.19 -177.9 0.21 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.599 1.559 . . . . 0.0 110.915 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -56.88 153.68 10.59 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.076 0.95 . . . . 0.0 110.828 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt -93.74 91.4 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3301 ' ' GLN . . . . . 0.423 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.76 64.33 2.74 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -136.52 -157.85 0.82 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -143.54 35.18 1.3 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.725 2.01 . . . . 0.0 112.463 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 116.158 -1.877 . . . . 0.0 112.318 -179.031 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 116.964 -1.493 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -65.51 92.95 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.706 1.139 . . . . 0.0 110.343 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt -154.04 149.22 12.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 124.925 1.29 . . . . 0.0 107.913 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t 48.86 29.53 2.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 pp -138.32 -177.67 4.95 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.803 2.441 . . . . 0.0 108.361 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.4 m -126.7 -53.92 1.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.787 1.235 . . . . 0.0 110.608 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.252 3.6 t -136.48 32.66 2.79 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 64.61 4.37 2.29 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 127.962 2.505 . . . . 0.0 115.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -21.7 -73.49 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 128.085 2.554 . . . . 0.0 113.653 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -148.84 44.65 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.49 -117.53 9.51 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.2 t -124.77 -62.69 1.22 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.197 1.399 . . . . 0.0 110.845 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 175.9 177.13 44.69 Favored Glycine 0 CA--C 1.526 0.719 0 O-C-N 120.824 -1.172 . . . . 0.0 111.82 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -73.59 -77.48 0.11 Allowed 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.271 1.028 . . . . 0.0 113.606 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.05 -123.2 1.15 Allowed Glycine 0 C--N 1.336 0.534 0 O-C-N 121.024 -1.048 . . . . 0.0 111.386 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 p -158.3 -168.57 2.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.384 1.074 . . . . 0.0 109.896 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -125.08 178.48 16.52 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.954 2.216 . . . . 0.0 108.693 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.5 m -103.17 -167.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 125.162 1.385 . . . . 0.0 109.596 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.57 154.73 25.73 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 107.179 -2.368 . . . . 0.0 107.179 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p -76.08 -69.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.215 1.006 . . . . 0.0 110.024 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 155.98 178.2 29.93 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.7 p -121.69 5.36 10.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.415 1.486 . . . . 0.0 112.346 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.55 -177.92 39.86 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 p -135.88 -175.5 3.99 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.705 1.602 . . . . 0.0 109.191 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 53.86 30.22 44.24 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 123.966 0.793 . . . . 0.0 113.835 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.3 p -139.67 -78.18 0.32 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.711 1.204 . . . . 0.0 108.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.34 -175.11 23.49 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 123.587 0.613 . . . . 0.0 111.66 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -154.38 158.06 39.49 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 125.518 1.527 . . . . 0.0 107.856 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.78 96.23 0.12 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 38.1 m -137.4 162.72 32.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.239 1.816 . . . . 0.0 108.959 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.22 -164.57 33.44 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t 77.94 170.31 0.21 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.993 2.117 . . . . 0.0 111.067 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 115.1 121.14 3.44 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.51 -2.236 . . . . 0.0 107.51 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.3 p -153.68 158.82 41.62 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 117.695 0.748 . . . . 0.0 110.214 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 151.84 -112.85 0.55 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 126.21 1.862 . . . . 0.0 109.076 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -67.65 -168.97 0.1 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.029 1.331 . . . . 0.0 113.176 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -62.73 178.53 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.499 1.52 . . . . 0.0 110.735 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt -104.93 95.51 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3301 ' ' GLN . . . . . 0.419 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.78 5.43 88.52 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -87.35 -166.77 1.67 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.048 2.139 . . . . 0.0 108.191 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -123.71 19.8 9.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.704 1.602 . . . . 0.0 111.695 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 58.2 mm-40 . . . . . 0 C--O 1.248 1.022 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 178.818 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.467 0.424 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.42 27.25 3.43 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.712 0.405 . . . . 0.0 111.276 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -155.7 168.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t 51.48 29.81 5.71 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.12 -173.47 3.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.41 1.884 . . . . 0.0 111.1 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -125.77 -70.81 0.72 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.63 1.572 . . . . 0.0 108.091 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -119.41 34.69 5.12 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.721 1.609 . . . . 0.0 111.427 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 57.49 36.75 27.3 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 148.83 11.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.306 0.643 . . . . 0.0 110.771 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -82.17 171.01 14.79 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.753 0.821 . . . . 0.0 108.807 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.84 106.57 2.65 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 124.844 1.212 . . . . 0.0 112.58 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 t -140.63 -7.95 1.1 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.919 1.688 . . . . 0.0 111.602 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -70.7 129.47 19.12 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 t -175.96 -169.48 0.33 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.781 2.432 . . . . 0.0 107.227 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.85 111.99 3.2 Favored Glycine 0 C--N 1.332 0.335 0 N-CA-C 108.388 -1.885 . . . . 0.0 108.388 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.4 m -140.45 158.04 44.6 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.678 0.791 . . . . 0.0 108.869 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.44 173.37 40.39 Favored Glycine 0 CA--C 1.519 0.305 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.4 t -147.67 -50.35 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.378 1.071 . . . . 0.0 108.909 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.26 -58.81 4.02 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p 57.73 -1.83 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.747 2.419 . . . . 0.0 116.331 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.96 169.3 39.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.7 t -168.54 -173.65 1.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.658 1.983 . . . . 0.0 106.576 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.01 15.07 79.91 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.257 -0.746 . . . . 0.0 114.051 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 t -150.17 169.86 20.31 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.97 1.385 . . . . 0.0 108.883 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.04 143.6 13.26 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.7 p -160.6 101.35 1.33 Allowed 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.818 -0.813 . . . . 0.0 109.506 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.77 170.69 26.84 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 178.16 0.74 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.666 2.386 . . . . 0.0 107.728 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.58 -171.05 43.07 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 125.677 1.608 . . . . 0.0 110.421 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.4 p -162.8 157.07 20.99 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.017 1.727 . . . . 0.0 108.426 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -136.37 157.65 23.64 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 108.178 -1.969 . . . . 0.0 108.178 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t -134.23 -164.55 1.52 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.036 1.334 . . . . 0.0 110.698 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.22 161.0 30.94 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.646 1.593 . . . . 0.0 109.6 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.6 t -160.47 -175.9 5.28 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.6 1.56 . . . . 0.0 108.239 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.62 -94.77 0.43 Allowed Glycine 0 C--N 1.336 0.581 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.08 176.63 8.68 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 126.381 1.872 . . . . 0.0 109.994 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -77.84 175.78 9.68 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.23 -0.919 . . . . 0.0 111.19 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt -74.07 93.94 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 125.551 1.541 . . . . 0.0 109.975 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3301 ' ' GLN . . . . . 0.409 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.81 56.83 22.02 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.05 177.88 7.92 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.399 2.28 . . . . 0.0 110.964 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -128.18 90.64 3.12 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.7 pp0? . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.801 177.836 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.423 ' C ' ' H ' ' A' ' 3' ' ' ILE . 21.3 ptm . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.055 -0.497 . . . . 0.0 111.832 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -70.19 12.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.145 1.778 . . . . 0.0 112.314 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.44 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp -164.15 168.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 127.984 2.513 . . . . 0.0 107.069 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.44 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.31 41.92 6.75 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.467 HD13 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -153.07 177.32 10.93 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.49 1.516 . . . . 0.0 108.1 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -112.76 -70.48 0.8 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.459 1.104 . . . . 0.0 110.023 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.0 t -125.92 51.75 1.73 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.91 1.684 . . . . 0.0 110.686 -177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.467 ' H ' HD13 ' A' ' 28' ' ' LEU . 92.6 mt-10 54.81 43.7 29.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.99 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 179.52 1.04 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -145.7 172.58 13.08 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 120.92 -1.113 . . . . 0.0 109.758 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.69 106.75 0.77 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.9 t -128.85 -179.2 4.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.664 1.986 . . . . 0.0 109.594 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.72 137.99 10.06 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.92 1.248 . . . . 0.0 110.455 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -142.59 179.97 6.66 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.729 2.012 . . . . 0.0 108.275 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.61 172.97 21.06 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -148.45 175.23 11.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.326 1.451 . . . . 0.0 107.265 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.2 -168.63 39.98 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.034 -1.626 . . . . 0.0 109.034 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.7 t -148.86 153.74 38.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 150.19 165.11 12.32 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.686 1.136 . . . . 0.0 110.325 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.0 p -81.34 117.3 21.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.205 1.002 . . . . 0.0 110.057 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.01 -97.51 0.17 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.26 -0.4 0.66 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.402 1.881 . . . . 0.0 115.26 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.46 147.76 50.12 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 119.276 0.944 . . . . 0.0 110.847 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 p 179.63 165.33 1.09 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.327 2.651 . . . . 0.0 107.082 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 177.61 -172.1 44.8 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 p -153.42 -56.98 0.12 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.174 0.989 . . . . 0.0 110.698 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.06 177.73 47.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 126.692 2.092 . . . . 0.0 109.458 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.2 p -147.55 173.88 12.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.409 1.884 . . . . 0.0 107.075 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -159.29 -163.67 13.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.6 m -152.85 140.75 20.16 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.983 -1.304 . . . . 0.0 109.544 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -165.96 162.69 36.18 Favored Glycine 0 C--O 1.24 0.523 0 C-N-CA 125.211 1.386 . . . . 0.0 110.116 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.6 t -102.88 145.02 30.43 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -114.02 175.03 15.99 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 125.39 1.472 . . . . 0.0 109.92 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 p -156.03 151.7 27.19 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 67.77 -166.8 42.71 Favored Glycine 0 CA--C 1.524 0.636 0 CA-C-O 122.149 0.86 . . . . 0.0 113.018 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -68.86 33.16 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 127.56 2.344 . . . . 0.0 114.791 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -77.55 -175.83 3.99 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 120.71 -1.244 . . . . 0.0 111.238 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt -117.37 88.7 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 125.376 1.47 . . . . 0.0 107.459 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.55 11.07 85.66 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.27 -174.03 2.83 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.61 1.964 . . . . 0.0 111.141 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -129.82 32.24 4.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.753 1.621 . . . . 0.0 112.887 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.238 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mmm . . . . . 0 N--CA 1.478 0.948 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -59.02 161.73 4.83 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.852 1.261 . . . . 0.0 112.749 -178.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt -56.05 124.01 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.456 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 48.98 26.28 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.458 HD12 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -139.48 161.37 37.64 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 126.143 1.777 . . . . 0.0 108.008 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.7 m -91.25 -42.59 10.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.391 1.476 . . . . 0.0 113.042 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -163.48 38.43 0.09 Allowed 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.462 1.125 . . . . 0.0 108.423 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.458 ' H ' HD12 ' A' ' 28' ' ' LEU . 32.7 mt-10 68.99 13.4 8.79 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.083 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.94 146.7 5.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 128.214 2.605 . . . . 0.0 109.481 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 50.86 26.48 2.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.726 1.21 . . . . 0.0 113.269 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -45.1 108.87 0.23 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.809 1.671 . . . . 0.0 113.194 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 58.24 15.63 3.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.435 1.494 . . . . 0.0 112.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -92.53 148.59 19.18 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 120.75 -1.219 . . . . 0.0 112.336 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 p -147.83 -103.62 0.09 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.79 -157.86 45.02 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.85 0.75 . . . . 0.0 111.507 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.1 m -74.52 -179.43 4.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.227 1.011 . . . . 0.0 111.049 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -119.75 159.45 14.87 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.201 -1.96 . . . . 0.0 108.201 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.1 t -147.66 -1.1 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.269 1.028 . . . . 0.0 113.041 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 161.74 -12.82 0.13 Allowed Glycine 0 CA--C 1.533 1.173 0 CA-C-N 120.476 1.489 . . . . 0.0 115.348 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 p 46.31 28.96 0.77 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.307 2.243 . . . . 0.0 116.238 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.407 ' C ' ' HG ' ' A' ' 45' ' ' SER . . . -67.7 148.42 49.49 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.407 ' HG ' ' C ' ' A' ' 44' ' ' GLY . 67.3 m -158.87 -6.83 0.07 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.576 1.15 . . . . 0.0 113.823 179.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.03 -164.41 31.1 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 120.22 1.373 . . . . 0.0 110.135 -179.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 165.8 26.88 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.369 1.067 . . . . 0.0 108.6 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.5 35.43 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.365 1.459 . . . . 0.0 113.585 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 58.2 m -147.64 -170.01 3.46 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.202 2.601 . . . . 0.0 108.651 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 176.97 -86.94 0.07 OUTLIER Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 t 45.91 81.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.558 2.343 . . . . 0.0 111.896 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.01 171.68 16.39 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.7 m -68.43 -48.74 63.81 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.544 1.138 . . . . 0.0 112.543 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.22 152.01 7.78 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.6 p -86.07 -176.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.329 1.452 . . . . 0.0 112.007 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -161.98 -178.77 36.16 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 129.029 3.204 . . . . 0.0 105.864 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 80.5 p -84.39 164.94 18.6 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 118.588 1.194 . . . . 0.0 111.433 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.46 164.1 27.75 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 109.155 -1.578 . . . . 0.0 109.155 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -74.4 -4.97 39.7 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.908 -0.76 . . . . 0.0 112.971 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -71.4 172.35 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.124 -0.985 . . . . 0.0 112.789 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt -79.47 102.89 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.671 1.588 . . . . 0.0 108.229 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 56.98 48.9 75.51 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -139.17 -178.01 5.16 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.883 2.073 . . . . 0.0 108.691 -178.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -135.86 82.76 1.97 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -83.44 45.63 1.07 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 121.097 1.771 . . . . 0.0 110.996 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp -159.82 171.16 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 125.207 1.403 . . . . 0.0 107.796 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 49.52 29.08 2.77 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.46 -178.27 5.43 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.538 1.935 . . . . 0.0 109.706 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.5 m -132.82 -35.32 1.09 Allowed 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.824 1.65 . . . . 0.0 112.338 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -154.18 33.28 0.43 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.455 1.502 . . . . 0.0 107.812 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 59.42 22.87 11.38 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.541 -1.349 . . . . 0.0 112.327 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -62.17 -32.25 72.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.554 1.942 . . . . 0.0 113.552 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -142.86 155.99 44.86 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.04 1.336 . . . . 0.0 108.71 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -175.83 -29.87 0.04 OUTLIER Glycine 0 CA--C 1.531 1.04 0 CA-C-O 118.451 -1.194 . . . . 0.0 114.299 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.6 m -61.3 159.82 11.71 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 119.437 1.618 . . . . 0.0 111.849 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 167.94 147.46 5.33 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.005 -1.238 . . . . 0.0 110.005 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 t -167.5 166.96 14.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 170.27 71.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 106.967 -2.453 . . . . 0.0 106.967 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.3 m -108.21 167.07 10.27 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.289 1.436 . . . . 0.0 109.985 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.28 -97.16 0.11 Allowed Glycine 0 C--N 1.332 0.335 0 N-CA-C 106.026 -2.83 . . . . 0.0 106.026 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.1 t -74.14 175.74 7.22 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.63 50.55 14.42 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 t -79.72 -172.75 3.47 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 -144.13 9.96 Favored Glycine 0 C--N 1.332 0.339 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.2 t -69.38 172.51 7.03 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.589 0.756 . . . . 0.0 110.592 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.99 -127.99 1.51 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -75.71 86.54 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -90.74 -2.48 72.28 Favored Glycine 0 CA--C 1.532 1.12 0 O-C-N 121.762 -0.587 . . . . 0.0 111.817 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.4 t 54.27 15.85 1.07 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.316 2.246 . . . . 0.0 113.382 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.89 -60.29 6.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 t 44.71 46.58 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.316 1.447 . . . . 0.0 110.78 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.53 -168.86 41.41 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 123.671 0.653 . . . . 0.0 111.879 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m 89.77 -8.82 0.38 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.488 3.115 . . . . 0.0 114.054 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.93 77.2 2.1 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.0 p -73.8 -57.08 4.22 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.755 0.777 . . . . 0.0 110.192 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.24 178.68 40.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.424 1.011 . . . . 0.0 112.261 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -143.04 163.6 32.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.319 1.847 . . . . 0.0 107.969 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -91.79 -22.04 32.03 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.274 -0.891 . . . . 0.0 114.672 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -117.58 159.59 22.65 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 124.084 0.954 . . . . 0.0 111.085 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -69.17 143.38 54.08 Favored 'General case' 0 C--O 1.231 0.079 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt -83.75 105.7 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 76.9 59.31 3.21 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -140.27 -172.65 3.47 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.507 1.923 . . . . 0.0 108.566 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 25.8 tt0 54.88 69.48 0.73 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.781 2.032 . . . . 0.0 111.119 179.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.741 2.416 . . . . 0.0 111.727 179.379 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptt? . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.428 -0.796 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -85.73 43.98 1.08 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.535 1.516 . . . . 0.0 111.163 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.7 tp -165.34 172.52 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.709 1.203 . . . . 0.0 109.875 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t 56.19 17.75 2.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -128.25 -176.11 3.71 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 125.901 1.681 . . . . 0.0 110.857 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.3 m -128.96 -43.19 1.35 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -148.5 23.22 1.02 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.992 0.901 . . . . 0.0 109.514 -178.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 60.19 39.25 19.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 110.884 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -32.68 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.03 0.932 . . . . 0.0 113.36 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 172.42 163.33 0.11 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 128.926 2.89 . . . . 0.0 110.27 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 126.83 2.64 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.3 p -147.13 -167.21 2.71 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.192 1.397 . . . . 0.0 109.047 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -170.21 176.95 43.74 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 107.444 -2.262 . . . . 0.0 107.444 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -144.99 178.08 8.29 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 117.919 0.859 . . . . 0.0 109.878 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.55 -155.35 31.24 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.503 1.525 . . . . 0.0 111.167 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.6 p -142.59 -172.8 3.71 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.098 1.359 . . . . 0.0 109.741 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.86 -177.45 14.9 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 125.764 1.649 . . . . 0.0 109.564 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.3 m -49.49 -53.39 23.47 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.186 1.394 . . . . 0.0 112.345 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 129.77 162.33 10.79 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 125.267 1.413 . . . . 0.0 110.52 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -175.93 137.32 0.33 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 128.59 2.756 . . . . 0.0 104.91 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.15 -171.09 14.58 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.363 0.982 . . . . 0.0 111.391 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.0 p -140.45 -93.99 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.454 1.102 . . . . 0.0 108.523 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 179.66 151.51 9.92 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 t -169.68 -33.25 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.648 1.179 . . . . 0.0 109.742 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 42.5 46.09 5.6 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 127.167 2.317 . . . . 0.0 114.204 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 t -83.06 -7.16 59.68 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -175.66 -89.61 0.08 OUTLIER Glycine 0 C--N 1.337 0.636 0 CA-C-N 121.058 1.754 . . . . 0.0 113.814 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m 52.72 26.3 4.37 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.618 1.167 . . . . 0.0 112.252 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.23 154.31 50.16 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.334 0.968 . . . . 0.0 113.839 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.6 m -73.9 177.41 5.6 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.405 1.082 . . . . 0.0 109.419 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.71 179.86 24.05 Favored Glycine 0 C--O 1.237 0.334 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 p -129.08 155.25 45.74 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.326 1.85 . . . . 0.0 108.03 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 58.16 -111.3 3.01 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 124.332 0.968 . . . . 0.0 111.442 -179.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -133.77 -27.23 1.5 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 126.514 1.926 . . . . 0.0 112.839 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 64.72 -132.64 37.63 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.301 0.955 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -87.35 -170.03 2.86 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.111 1.365 . . . . 0.0 108.936 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -60.85 158.93 12.06 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.628 -0.67 . . . . 0.0 110.37 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt -88.86 105.48 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3295 ' ' GLN . . . . . 0.5 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 75.64 63.82 2.38 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 6.5 t70 -138.63 -172.01 3.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.072 1.749 . . . . 0.0 110.575 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.41 70.06 1.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.451 1.9 . . . . 0.0 109.88 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 C--O 1.249 1.027 0 O-C-N 121.74 -0.6 . . . . 0.0 110.099 179.667 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.5 mtm . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -86.23 69.61 10.48 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.121 0.969 . . . . 0.0 110.668 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.451 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp -173.2 162.31 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 127.667 2.387 . . . . 0.0 108.839 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.01 26.11 9.59 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -139.23 -169.47 2.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.565 1.146 . . . . 0.0 113.102 -177.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -131.61 -28.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.5 t -156.98 19.99 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.97 0.805 . . . . 0.0 110.461 -177.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 66.87 32.39 6.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.727 0.811 . . . . 0.0 109.018 -178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 156.95 18.27 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -102.21 151.47 22.17 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 -152.75 9.8 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.411 1.005 . . . . 0.0 112.248 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.9 m -79.7 156.45 27.55 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.83 1.252 . . . . 0.0 108.424 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -177.77 171.04 43.6 Favored Glycine 0 C--N 1.334 0.469 0 O-C-N 120.626 -1.296 . . . . 0.0 112.453 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -70.66 157.66 37.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.601 1.56 . . . . 0.0 111.433 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.57 -164.69 0.14 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 129.191 3.281 . . . . 0.0 117.57 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.5 p -149.82 -172.27 4.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.336 1.855 . . . . 0.0 110.528 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -128.52 174.13 19.0 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.573 1.082 . . . . 0.0 113.061 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.4 m -128.33 -175.39 3.49 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.181 1.393 . . . . 0.0 111.737 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.1 -170.24 24.11 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.615 1.579 . . . . 0.0 112.474 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -164.43 174.15 11.32 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.434 1.893 . . . . 0.0 108.387 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.32 -167.19 14.97 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 128.69 3.043 . . . . 0.0 109.923 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.2 m -155.22 167.05 31.65 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.127 2.171 . . . . 0.0 108.506 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.74 175.18 43.84 Favored Glycine 0 CA--C 1.525 0.663 0 O-C-N 121.464 -0.773 . . . . 0.0 111.514 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.3 p -163.54 162.34 24.44 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 125.073 1.349 . . . . 0.0 110.05 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 143.04 151.55 5.5 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 m -139.4 160.05 40.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.611 1.164 . . . . 0.0 108.065 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.04 -160.75 28.43 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.8 p -109.51 112.13 24.04 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.974 0.909 . . . . 0.0 111.298 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.86 -65.3 0.12 Allowed Glycine 0 C--N 1.332 0.354 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 179.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 m 50.15 68.83 0.69 Allowed 'General case' 0 C--O 1.237 0.435 0 C-N-CA 126.399 1.879 . . . . 0.0 110.909 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.37 167.62 19.26 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.953 0.787 . . . . 0.0 113.238 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.6 t -138.18 177.05 8.17 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.459 2.303 . . . . 0.0 107.93 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -127.03 -129.0 3.2 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 106.361 -2.696 . . . . 0.0 106.361 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.7 p -159.56 170.55 21.4 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.375 1.588 . . . . 0.0 110.771 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -132.0 88.08 0.28 Allowed Glycine 0 C--N 1.335 0.515 0 C-N-CA 126.398 1.951 . . . . 0.0 109.344 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -127.08 -11.86 5.85 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.378 1.089 . . . . 0.0 113.68 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -86.31 -175.27 5.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.717 1.207 . . . . 0.0 111.395 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -84.64 98.91 6.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 61.72 52.75 48.62 Favored Glycine 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.1 t0 -126.6 161.59 27.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.786 1.634 . . . . 0.0 111.063 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -145.69 30.84 1.08 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 123.973 0.909 . . . . 0.0 111.131 -178.825 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -77.48 -153.93 0.06 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 177.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp -72.8 166.0 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.01 30.18 3.92 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 pp -136.08 -177.32 4.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 125.738 1.615 . . . . 0.0 111.509 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 71.0 m -135.16 -40.25 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 128.907 2.883 . . . . 0.0 112.426 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.2 t -147.99 14.81 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.113 1.365 . . . . 0.0 110.171 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 69.59 47.76 0.64 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.591 -1.318 . . . . 0.0 109.127 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 163.33 28.28 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.662 1.585 . . . . 0.0 107.318 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -140.33 156.43 46.44 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.099 -1.001 . . . . 0.0 110.198 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 131.06 81.66 0.23 Allowed Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.3 t -126.93 155.85 42.43 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 109.566 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.18 156.51 32.33 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.763 1.649 . . . . 0.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -155.82 -49.76 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.21 -171.96 38.67 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m 60.18 -10.62 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.09 61.34 4.7 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.4 m -56.57 -10.76 1.06 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.45 2.3 . . . . 0.0 115.482 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.42 -23.38 73.48 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 119.577 1.08 . . . . 0.0 111.861 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.5 t 56.91 5.7 0.25 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.146 1.778 . . . . 0.0 114.81 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.88 -100.0 1.72 Allowed Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.691 1.587 . . . . 0.0 109.737 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.3 t 56.39 14.87 1.76 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -47.18 111.87 0.84 Allowed Glycine 0 C--N 1.339 0.707 0 C-N-CA 125.357 1.456 . . . . 0.0 112.123 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -127.64 156.54 42.15 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.069 1.347 . . . . 0.0 108.884 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 162.39 -115.03 0.63 Allowed Glycine 0 CA--C 1.521 0.449 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.3 m 65.37 85.48 0.14 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.253 1.821 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.21 158.76 25.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.6 m -159.61 166.1 31.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.347 1.459 . . . . 0.0 110.211 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.19 -140.46 2.9 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.25 -19.1 8.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.376 1.088 . . . . 0.0 111.86 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -175.07 166.42 38.03 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 119.987 1.267 . . . . 0.0 111.397 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -128.43 157.66 40.46 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.38 1.072 . . . . 0.0 109.547 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.544 ' H ' ' CG2' ' A' 3297 ' ' ILE . . . -54.19 148.74 18.95 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 125.074 1.321 . . . . 0.0 111.611 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -93.49 175.13 6.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.018 1.727 . . . . 0.0 113.684 -178.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.22 -171.1 51.61 Favored Glycine 0 CA--C 1.526 0.759 0 O-C-N 121.316 -0.865 . . . . 0.0 113.579 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -65.75 30.32 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.086 2.554 . . . . 0.0 115.08 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.25 174.82 10.8 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.147 -1.596 . . . . 0.0 107.794 177.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -101.36 94.86 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.147 0.979 . . . . 0.0 108.95 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3297 ' ' ILE . . . . . 0.544 ' CG2' ' H ' ' A' ' 56' ' ' GLY . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 57.76 51.2 59.47 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 7.6 p30 -90.29 -168.19 2.04 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.227 1.411 . . . . 0.0 111.861 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.29 24.64 5.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 127.321 2.249 . . . . 0.0 113.13 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.574 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -133.99 38.3 3.19 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 122.221 2.282 . . . . 0.0 112.433 -177.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.9 tt -163.78 162.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 O-C-N 121.579 -0.701 . . . . 0.0 111.1 -179.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.84 23.64 1.5 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -134.57 -174.45 3.58 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 127.473 2.309 . . . . 0.0 111.273 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 m -128.93 -40.51 1.51 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.093 1.757 . . . . 0.0 110.788 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -153.85 34.01 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.425 0.69 . . . . 0.0 110.016 -178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 58.97 31.57 21.47 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.25 -0.906 . . . . 0.0 112.102 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.48 141.87 11.52 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 124.944 1.298 . . . . 0.0 113.357 -178.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -58.32 -42.77 87.51 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.0 -155.02 43.93 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.16 -1.576 . . . . 0.0 109.16 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -151.16 -171.52 3.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.562 1.145 . . . . 0.0 109.712 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -153.77 -174.17 23.68 Favored Glycine 0 CA--C 1.527 0.794 0 C-N-CA 126.201 1.858 . . . . 0.0 108.907 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -141.75 -169.85 2.99 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.613 1.165 . . . . 0.0 109.062 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.26 -1.87 2.8 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 126.821 2.153 . . . . 0.0 111.38 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 p -144.21 -168.25 2.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.557 1.943 . . . . 0.0 107.82 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.69 -167.51 26.48 Favored Glycine 0 CA--C 1.532 1.128 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.9 p 51.17 75.87 0.18 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.7 1.6 . . . . 0.0 113.228 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.68 160.12 51.59 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.725 -1.75 . . . . 0.0 108.725 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.3 m -149.47 150.39 32.27 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.812 0.845 . . . . 0.0 109.768 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.05 13.37 Favored Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.759 1.171 . . . . 0.0 110.967 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.4 m -152.71 161.79 42.11 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 126.776 2.03 . . . . 0.0 107.848 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -162.66 162.01 34.17 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.3 t -157.96 150.72 22.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.409 1.084 . . . . 0.0 109.211 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 173.02 162.85 25.81 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 107.82 -2.112 . . . . 0.0 107.82 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.8 m -163.47 -84.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 125.748 1.619 . . . . 0.0 106.991 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.44 169.73 6.85 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 122.074 0.819 . . . . 0.0 112.053 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.3 t -132.0 140.15 48.85 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.188 1.395 . . . . 0.0 107.313 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.68 -168.22 20.42 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.751 0.691 . . . . 0.0 112.791 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -174.94 117.45 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.266 2.626 . . . . 0.0 105.802 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -156.39 36.14 0.59 Allowed Glycine 0 CA--C 1.524 0.597 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.491 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.3 m -64.04 173.11 2.01 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.135 0.967 . . . . 0.0 108.985 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.03 -165.31 25.34 Favored Glycine 0 CA--C 1.523 0.541 0 O-C-N 121.352 -0.842 . . . . 0.0 113.798 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.264 45.8 p 54.74 35.06 23.12 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.584 2.354 . . . . 0.0 113.034 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.77 -177.91 19.98 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -112.38 14.26 20.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.893 1.277 . . . . 0.0 108.741 179.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -66.26 155.75 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.761 2.424 . . . . 0.0 109.747 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt -72.9 98.85 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.64 57.87 16.75 Favored Glycine 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -145.47 -155.45 0.61 Allowed 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.137 0.975 . . . . 0.0 111.06 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -135.37 31.88 3.14 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.998 1.719 . . . . 0.0 110.933 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.415 0 C-N-CA 124.063 0.945 . . . . 0.0 109.518 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -140.21 13.47 2.41 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 120.673 -1.267 . . . . 0.0 112.274 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt -153.88 174.23 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 121.502 -0.749 . . . . 0.0 111.663 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 46.71 32.39 1.71 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -136.44 -175.28 3.95 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.556 1.542 . . . . 0.0 112.758 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -120.46 -43.54 2.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.51 1.924 . . . . 0.0 114.312 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.44 ' CG2' ' HE2' ' A' ' 32' ' ' LYS . 12.1 t -152.79 31.15 0.5 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.473 0.579 . . . . 0.0 111.062 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 61.72 32.36 18.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.257 0.623 . . . . 0.0 110.998 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.44 ' HE2' ' CG2' ' A' ' 30' ' ' THR . 10.3 ttmm -70.88 170.88 11.69 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.541 1.137 . . . . 0.0 109.955 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.18 -177.86 3.15 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.997 0.903 . . . . 0.0 111.379 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.04 155.25 11.72 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 126.91 2.195 . . . . 0.0 108.588 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.7 t -175.8 137.65 0.35 Allowed 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.402 1.481 . . . . 0.0 110.065 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -136.9 172.31 22.66 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 127.679 2.561 . . . . 0.0 108.608 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -137.89 165.71 25.82 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.575 1.187 . . . . 0.0 109.705 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.0 171.49 30.0 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 124.535 1.064 . . . . 0.0 112.514 -179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.7 m -109.34 -96.9 0.39 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.53 -171.44 40.77 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 126.243 1.878 . . . . 0.0 108.492 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.9 m -140.45 171.54 14.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.145 1.378 . . . . 0.0 108.592 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.1 167.82 19.42 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.028 0.823 . . . . 0.0 111.126 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -77.02 163.73 26.41 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.095 1.358 . . . . 0.0 111.168 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -117.68 155.74 15.98 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.9 t -82.26 71.05 9.32 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.746 0.818 . . . . 0.0 109.325 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.77 -169.72 42.8 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.1 p -143.23 164.25 30.71 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 148.17 -169.16 28.89 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 107.403 -2.279 . . . . 0.0 107.403 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -158.02 165.56 34.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.046 0.923 . . . . 0.0 108.77 179.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 154.13 162.39 11.1 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.415 1.959 . . . . 0.0 108.349 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.4 t -173.31 161.92 4.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.38 1.872 . . . . 0.0 106.248 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 162.14 173.49 30.88 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-N 118.938 0.79 . . . . 0.0 112.858 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 m -172.5 162.46 5.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.937 2.495 . . . . 0.0 108.519 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -167.08 166.06 38.96 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.817 2.151 . . . . 0.0 109.027 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.7 m -160.04 172.61 17.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.917 1.687 . . . . 0.0 110.419 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.56 170.98 35.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.674 1.131 . . . . 0.0 110.948 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.0 p 151.67 145.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 130.429 3.492 . . . . 0.0 111.235 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -108.44 -65.17 0.57 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -88.35 -171.08 3.21 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.215 1.406 . . . . 0.0 109.504 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -57.7 155.82 9.47 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt -95.2 98.34 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 81.15 44.01 8.36 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.8 t70 37.09 67.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 129.521 3.128 . . . . 0.0 113.146 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -148.98 31.16 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.531 1.132 . . . . 0.0 113.373 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 . . . . . 0 N--CA 1.435 -1.224 0 C-N-CA 126.298 1.839 . . . . 0.0 107.104 179.32 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -63.39 146.6 53.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 123.587 0.554 . . . . 0.0 109.767 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt -58.87 155.11 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 O-C-N 123.388 0.43 . . . . 0.0 110.72 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t 44.92 49.66 9.13 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -150.2 -174.34 4.7 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.346 1.07 . . . . 0.0 110.914 -178.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -124.61 -46.49 1.87 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 127.18 2.192 . . . . 0.0 111.364 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 33.33 0.4 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.864 0.866 . . . . 0.0 109.877 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 66.29 31.33 8.53 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 120.991 -1.068 . . . . 0.0 110.546 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -71.93 166.99 21.02 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -70.53 -52.89 18.63 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.354 -0.841 . . . . 0.0 109.1 178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 46.19 66.92 1.5 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 126.009 1.766 . . . . 0.0 114.342 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.9 t -124.03 -172.17 2.48 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 124.201 1.001 . . . . 0.0 108.517 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.78 95.88 1.02 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 124.803 1.192 . . . . 0.0 111.47 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.9 m -144.8 165.14 28.96 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 108.734 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.0 103.18 0.17 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.8 p -150.86 175.26 12.2 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.584 1.192 . . . . 0.0 111.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.87 -68.56 0.01 OUTLIER Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 t 64.78 7.25 3.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.869 1.668 . . . . 0.0 115.031 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -160.42 165.33 34.9 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-N 120.654 1.57 . . . . 0.0 109.511 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.9 p -122.54 -22.02 5.55 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.995 1.318 . . . . 0.0 113.162 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.86 92.17 0.13 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 107.767 -2.133 . . . . 0.0 107.767 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -147.77 84.43 1.54 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 163.01 -170.8 38.62 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.8 t -153.17 -92.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.89 153.99 53.15 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 108.391 -1.883 . . . . 0.0 108.391 178.272 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 30.5 p -153.4 -176.83 5.98 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.608 1.163 . . . . 0.0 108.321 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.49 165.65 30.99 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.7 t -160.48 168.77 24.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.51 163.17 32.16 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t -147.18 -173.58 4.28 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -160.12 172.54 36.62 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 125.61 1.576 . . . . 0.0 109.528 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.2 t 176.59 179.98 0.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.751 2.82 . . . . 0.0 107.656 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 147.86 -167.32 28.8 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 p -118.39 156.76 28.41 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.55 -175.1 9.8 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.389 0.995 . . . . 0.0 110.728 -178.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 48.94 85.3 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.885 1.674 . . . . 0.0 112.016 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -59.4 157.29 11.36 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.188 0.595 . . . . 0.0 111.046 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt -97.03 89.62 2.11 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.37 23.2 65.94 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.22 -164.68 0.96 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.143 1.777 . . . . 0.0 109.42 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -140.6 25.3 2.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.428 1.091 . . . . 0.0 112.717 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.92 0 C-N-CA 127.159 2.184 . . . . 0.0 107.844 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 ptm . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.84 115.96 12.76 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 103.12 -2.919 . . . . 0.0 103.12 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt -62.08 158.29 3.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t 45.29 42.2 6.99 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.426 HD13 ' H ' ' A' ' 31' ' ' GLU . 3.6 pp -147.72 -175.75 4.99 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.697 1.199 . . . . 0.0 111.007 -177.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 m -113.75 -51.22 2.8 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.513 1.525 . . . . 0.0 111.337 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -155.51 37.94 0.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 122.143 0.973 . . . . 0.0 109.537 -178.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.426 ' H ' HD13 ' A' ' 28' ' ' LEU . 20.2 mt-10 64.82 13.38 8.45 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.747 -1.221 . . . . 0.0 111.973 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.05 -68.33 0.18 Allowed 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.887 1.675 . . . . 0.0 111.086 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -167.25 166.42 14.8 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.727 0.811 . . . . 0.0 110.268 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -174.11 147.7 9.48 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 126.685 2.088 . . . . 0.0 108.36 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.1 m -167.06 177.8 6.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.969 1.708 . . . . 0.0 109.87 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -175.61 160.34 28.65 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.3 m -170.86 178.84 3.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.004 2.522 . . . . 0.0 107.874 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 105.57 0.27 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 t -143.66 171.1 14.65 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.775 1.23 . . . . 0.0 109.355 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.22 -34.39 3.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.836 1.208 . . . . 0.0 113.744 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 80.3 p -71.17 18.32 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.462 1.631 . . . . 0.0 114.453 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -107.59 82.36 0.31 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.584 -2.606 . . . . 0.0 106.584 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.7 m -147.64 162.36 39.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.039 1.336 . . . . 0.0 108.302 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.84 176.57 44.18 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.0 p -82.02 62.57 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.372 1.069 . . . . 0.0 108.524 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 130.13 -155.75 21.18 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.4 m -92.66 151.34 20.14 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.517 0.727 . . . . 0.0 110.61 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -80.43 113.13 3.58 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 108.345 -1.902 . . . . 0.0 108.345 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -75.7 2.87 10.89 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.814 1.245 . . . . 0.0 113.408 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -163.4 169.93 38.63 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.296 -1.521 . . . . 0.0 109.296 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.9 m -120.13 175.9 5.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.131 1.373 . . . . 0.0 111.413 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -96.19 168.64 25.88 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.3 m -143.43 143.5 31.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.73 171.67 24.11 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.5 m -153.49 -177.1 6.13 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.903 1.681 . . . . 0.0 108.564 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -131.21 -175.33 13.96 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.245 1.879 . . . . 0.0 109.911 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -127.28 -93.38 0.47 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.402 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.53 -75.58 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 120.179 1.354 . . . . 0.0 112.698 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -74.17 -161.88 0.13 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.761 1.224 . . . . 0.0 111.031 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -65.21 178.05 0.96 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.471 -0.768 . . . . 0.0 111.747 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt -113.42 92.08 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.52 46.85 37.83 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.34 -170.27 2.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.727 1.611 . . . . 0.0 111.124 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -121.52 28.45 7.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.147 2.179 . . . . 0.0 110.604 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 . . . . . 0 C--O 1.241 0.653 0 C-N-CA 125.881 1.672 . . . . 0.0 109.883 -179.252 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -78.62 80.25 5.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt -153.44 156.62 5.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 126.219 1.807 . . . . 0.0 107.54 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.402 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.418 ' HE2' HD22 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.402 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.444 ' C ' ' H ' ' A' ' 28' ' ' LEU . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.9 0.7 0.12 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.444 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.3 pp -100.75 -177.9 3.61 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 128.172 2.589 . . . . 0.0 111.205 -179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.7 m -134.81 -41.45 0.76 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 125.646 1.578 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -157.92 37.0 0.26 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 53.98 31.49 13.6 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.302 1.049 . . . . 0.0 109.414 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -65.6 150.35 48.57 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.233 2.213 . . . . 0.0 109.283 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -131.81 170.14 15.25 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.227 1.011 . . . . 0.0 108.842 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 128.53 111.99 1.62 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 107.927 -2.069 . . . . 0.0 107.927 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 m -135.13 165.29 25.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.272 1.829 . . . . 0.0 108.524 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -174.7 -166.52 32.75 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 108.952 -1.659 . . . . 0.0 108.952 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.2 t -60.7 157.61 14.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.19 0.995 . . . . 0.0 108.96 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.36 -13.96 7.91 Favored Glycine 0 CA--C 1.524 0.63 0 CA-C-O 119.268 -0.74 . . . . 0.0 113.418 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -64.02 121.37 13.96 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.715 1.257 . . . . 0.0 109.405 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 149.96 -172.96 29.79 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 109.253 -1.539 . . . . 0.0 109.253 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 t -128.65 159.65 34.92 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.39 94.81 0.1 OUTLIER Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 106.236 -2.746 . . . . 0.0 106.236 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.2 m -58.71 -50.68 73.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.88 0.84 . . . . 0.0 110.969 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 149.5 -140.67 8.27 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -148.7 -40.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 117.662 0.731 . . . . 0.0 110.643 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.07 164.27 39.9 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.314 -1.115 . . . . 0.0 110.314 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -139.29 -1.44 1.72 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.424 1.09 . . . . 0.0 113.279 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 178.39 156.41 16.76 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-N 119.603 1.092 . . . . 0.0 110.72 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -75.22 -71.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.014 0.926 . . . . 0.0 109.813 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 165.4 -178.59 40.26 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 126.098 1.809 . . . . 0.0 109.581 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.8 t -154.19 -88.11 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 103.6 -2.741 . . . . 0.0 103.6 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.64 -171.18 36.2 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 108.354 -1.898 . . . . 0.0 108.354 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 m -118.28 3.96 11.93 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.696 -0.884 . . . . 0.0 112.976 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.31 178.65 9.08 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-O 122.257 0.921 . . . . 0.0 112.315 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -172.56 -138.84 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 104.548 -2.39 . . . . 0.0 104.548 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.9 179.73 16.5 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 125.371 1.462 . . . . 0.0 109.749 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.6 t -163.28 175.18 11.16 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.8 49.9 1.88 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 124.809 1.195 . . . . 0.0 111.333 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 51.16 39.0 22.52 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.234 1.414 . . . . 0.0 111.958 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -63.91 170.74 3.25 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.254 0.55 . . . . 0.0 111.755 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt -107.82 85.26 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3304 ' ' LEU . . . . . 0.418 HD22 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.89 61.44 3.78 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 13.8 m-20 30.26 64.4 0.16 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.218 3.007 . . . . 0.0 111.591 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3320 ' ' GLN . . . . . 0.518 ' H ' ' NE2' ' A' 3321 ' ' GLN . 28.5 tt0 -147.11 68.82 1.15 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.521 1.528 . . . . 0.0 108.144 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3321 ' ' GLN . . . . . 0.518 ' NE2' ' H ' ' A' 3320 ' ' GLN . 1.8 mp0 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.826 1.251 . . . . 0.0 108.976 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mmt . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -62.53 128.25 35.12 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt -59.84 148.1 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t 55.0 16.94 1.66 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 pp -121.88 -172.55 2.46 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.813 2.045 . . . . 0.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.7 m -127.83 -45.48 1.44 Allowed 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 125.075 1.35 . . . . 0.0 112.912 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 t -152.67 31.63 0.51 Allowed 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 62.32 45.8 6.42 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -66.01 161.33 21.75 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 125.816 1.646 . . . . 0.0 111.636 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -115.19 -32.83 5.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.549 0.74 . . . . 0.0 110.541 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.6 136.19 47.45 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 107.745 -2.142 . . . . 0.0 107.745 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 p -140.87 -66.35 0.43 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.445 0.623 . . . . 0.0 112.006 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.54 157.29 21.59 Favored Glycine 0 CA--C 1.528 0.873 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 m -150.95 175.24 12.25 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.284 1.433 . . . . 0.0 108.062 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.46 149.36 9.33 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -160.15 155.89 25.79 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 46.85 19.4 0.52 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.756 2.122 . . . . 0.0 116.347 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.3 p -157.3 160.47 38.59 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.414 1.607 . . . . 0.0 109.496 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 166.92 147.99 5.44 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.3 m -150.79 43.31 0.81 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.349 1.074 . . . . 0.0 110.457 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.32 -141.95 15.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 t 68.52 32.6 4.32 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.164 1.386 . . . . 0.0 111.437 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.19 135.75 12.87 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 124.837 1.208 . . . . 0.0 111.469 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.0 p -155.66 177.71 11.08 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.103 0.961 . . . . 0.0 110.075 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.21 176.58 47.06 Favored Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.272 -1.531 . . . . 0.0 109.272 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.13 174.47 11.29 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 163.03 174.46 32.96 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 109.171 -1.571 . . . . 0.0 109.171 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.4 p -144.36 -169.39 3.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.64 -32.89 8.86 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.381 -1.233 . . . . 0.0 114.622 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.2 t -77.35 96.26 4.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.62 1.71 . . . . 0.0 110.438 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.47 120.93 1.21 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.5 p -138.81 -68.57 0.44 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.647 1.179 . . . . 0.0 111.474 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.29 -179.38 32.15 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.39 1.947 . . . . 0.0 110.131 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 m -154.21 124.02 6.72 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 120.56 -1.553 . . . . 0.0 108.651 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 104.11 176.51 25.48 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 109.124 -1.591 . . . . 0.0 109.124 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -72.37 43.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.859 1.664 . . . . 0.0 113.127 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -72.87 172.63 10.51 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.33 -0.856 . . . . 0.0 109.594 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt -84.14 104.71 12.78 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 73.91 33.64 57.19 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -127.84 176.59 7.45 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 128.048 2.539 . . . . 0.0 109.027 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -149.63 85.62 1.44 Allowed 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.109 177.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.7 mtm . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -64.66 143.25 58.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp -57.8 146.6 7.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.543 ' C ' ' H ' ' A' ' 28' ' ' LEU . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t 57.3 -8.36 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.543 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -94.91 179.57 5.18 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.139 2.976 . . . . 0.0 110.679 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.2 m -121.72 -61.58 1.49 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.475 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 t -136.98 36.06 2.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 109.186 -178.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 61.09 25.09 15.15 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.21 1.404 . . . . 0.0 111.118 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -69.91 121.16 16.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.261 2.624 . . . . 0.0 110.745 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -74.25 -34.57 63.65 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 123.849 0.718 . . . . 0.0 110.085 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.75 -101.19 1.9 Allowed Glycine 0 C--N 1.335 0.477 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.0 p -178.23 176.25 1.12 Allowed 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.994 1.318 . . . . 0.0 109.905 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 171.91 69.7 0.04 OUTLIER Glycine 0 C--N 1.334 0.45 0 CA-C-O 119.234 -0.759 . . . . 0.0 111.532 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.6 p -154.68 176.68 12.13 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.098 0.959 . . . . 0.0 109.421 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.71 -69.06 0.78 Allowed Glycine 0 C--N 1.337 0.594 0 N-CA-C 108.488 -1.845 . . . . 0.0 108.488 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -78.25 69.68 4.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.334 1.054 . . . . 0.0 109.388 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.7 -167.64 33.66 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 108.543 -1.823 . . . . 0.0 108.543 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.1 m -154.46 146.99 24.06 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 121.477 -1.014 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -175.44 177.71 47.24 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 127.993 2.711 . . . . 0.0 107.919 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.5 p -162.86 -167.45 1.53 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 117.901 0.851 . . . . 0.0 108.998 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -161.38 173.43 37.78 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.0 m -156.98 123.03 4.84 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.88 14.51 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t 45.02 45.26 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.938 2.095 . . . . 0.0 113.734 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.76 105.5 0.38 Allowed Glycine 0 C--N 1.337 0.62 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.9 t -124.33 -66.32 0.99 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.103 1.361 . . . . 0.0 108.575 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.56 176.27 47.08 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 125.114 1.34 . . . . 0.0 111.742 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 p -132.95 167.89 19.45 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.541 1.537 . . . . 0.0 109.027 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 130.43 -154.84 20.83 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.19 91.71 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.895 2.478 . . . . 0.0 106.643 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.53 163.34 9.65 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.134 0.852 . . . . 0.0 113.421 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.9 t -132.26 178.19 7.0 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.374 2.27 . . . . 0.0 108.422 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -110.98 179.06 19.9 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 126.093 1.806 . . . . 0.0 110.3 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -149.77 174.54 12.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.379 1.072 . . . . 0.0 109.776 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -135.55 -19.14 0.76 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.947 0.784 . . . . 0.0 112.97 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -88.3 4.73 44.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.749 1.274 . . . . 0.0 113.938 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -128.82 -173.9 3.1 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.037 2.135 . . . . 0.0 108.616 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt -102.25 93.07 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3316 ' ' LEU . . . . . . . . . . . . . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 68.68 54.43 15.3 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.03 108.45 0.67 Allowed 'General case' 0 C--O 1.232 0.173 0 C-N-CA 126.109 1.764 . . . . 0.0 109.525 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -146.86 91.7 2.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.364 -2.458 . . . . 0.0 104.364 -179.847 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp . . . . . 0 C--O 1.235 0.318 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' 3316 ' ' LEU . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.606 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.562 HG23 HD23 ' A' 3316 ' ' LEU . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.502 HD12 HD11 ' A' 3297 ' ' ILE . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HA ' HG22 ' A' ' 24' ' ' ILE . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.42 HG22 ' HA ' ' A' ' 21' ' ' LYS . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt . . . . . 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.606 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.55 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.422 HG23 HD23 ' A' 3316 ' ' LEU . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 15' ' ' VAL . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.435 HD12 HD11 ' A' 3297 ' ' ILE . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' 3296 ' ' ASP . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3296 ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.435 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.433 HD22 HD11 ' A' 3316 ' ' LEU . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.55 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.446 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.534 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.434 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.434 HG22 ' O ' ' A' ' 20' ' ' ILE . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--O 1.233 0.227 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 HD21 ' A' 3316 ' ' LEU . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.574 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 13' ' ' GLN . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t . . . . . 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3301 ' ' GLN . . . . . 0.405 ' CB ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.624 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 110.464 -0.198 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.516 HG23 HD23 ' A' 3316 ' ' LEU . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.408 ' HB3' HD12 ' A' 3304 ' ' LEU . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.434 HD12 ' CD1' ' A' 3297 ' ' ILE . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.434 ' CD1' HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3304 ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 16' ' ' LEU . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3305 ' ' GLU . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.628 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt . . . . . 0 C--O 1.238 0.497 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.42 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.591 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 HD23 ' A' 3316 ' ' LEU . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.167 0.508 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.591 HD21 HD12 ' A' ' 11' ' ' LEU . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp . . . . . 0 N--CA 1.444 -0.754 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.437 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.541 ' HA ' HD23 ' A' ' 11' ' ' LEU . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.464 ' HG2' HD22 ' A' ' 11' ' ' LEU . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.599 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.582 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.533 HG23 HD23 ' A' 3316 ' ' LEU . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.599 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.448 -0.54 0 CA-C-O 123.405 1.574 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.599 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 HD23 ' A' 3316 ' ' LEU . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3301 ' ' GLN . . . . . 0.419 ' HA ' HD13 ' A' 3304 ' ' LEU . 0.6 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3303 ' ' GLU . . . . . 0.486 ' HG2' HD12 ' A' 3304 ' ' LEU . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3304 ' ' LEU . . . . . 0.486 HD12 ' HG2' ' A' 3303 ' ' GLU . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.599 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp . . . . . 0 C--O 1.231 0.08 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.666 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.48 HG23 HD23 ' A' 3316 ' ' LEU . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.466 ' O ' HG22 ' A' ' 24' ' ' ILE . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.666 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.511 HG21 ' HB2' ' A' ' 6' ' ' GLN . 3.7 tp . . . . . 0 C--O 1.236 0.384 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.511 ' HB2' HG21 ' A' ' 3' ' ' ILE . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 11' ' ' LEU . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3295 ' ' GLN . . . . . 0.551 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp . . . . . 0 N--CA 1.469 0.483 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.454 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 11' ' ' LEU . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.482 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.422 HD12 HD11 ' A' 3297 ' ' ILE . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.422 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3305 ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.482 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 11' ' ' LEU . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HG2' HD22 ' A' ' 11' ' ' LEU . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.536 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.52 HG23 HD23 ' A' 3316 ' ' LEU . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.426 ' O ' HG22 ' A' ' 24' ' ' ILE . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 122.025 0.917 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.536 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 6' ' ' GLN . 7.9 tt . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.544 0.211 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.524 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.407 ' HB3' HD12 ' A' 3304 ' ' LEU . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HA ' HG22 ' A' ' 24' ' ' ILE . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.437 HG22 ' HA ' ' A' ' 21' ' ' LYS . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3298 ' ' GLU . . . . . 0.407 ' HA ' ' HG3' ' A' 3301 ' ' GLN . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3301 ' ' GLN . . . . . 0.407 ' HG3' ' HA ' ' A' 3298 ' ' GLU . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3304 ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 16' ' ' LEU . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3305 ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.528 0.116 0 CA-C-O 120.998 0.428 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.677 HD12 HD21 ' A' 3316 ' ' LEU . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.602 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.403 HD12 HD11 ' A' 3297 ' ' ILE . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.403 HD11 HD12 ' A' ' 20' ' ' ILE . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.677 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.821 0.343 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.438 HG23 HD23 ' A' 3316 ' ' LEU . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.485 HD12 HD11 ' A' 3297 ' ' ILE . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.485 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.438 HD23 HG23 ' A' ' 15' ' ' VAL . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' 3309 ' ' GLU . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.56 HD12 HD21 ' A' 3316 ' ' LEU . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.421 HG23 HD23 ' A' 3316 ' ' LEU . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' 3304 ' ' LEU . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.412 HD12 HD11 ' A' 3297 ' ' ILE . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3297 ' ' ILE . . . . . 0.412 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3304 ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 16' ' ' LEU . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3305 ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.45 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.56 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HG2' HD22 ' A' ' 11' ' ' LEU . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.782 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.588 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.661 HG23 HD23 ' A' 3316 ' ' LEU . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HE2' HD21 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3304 ' ' LEU . . . . . 0.481 HD21 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.782 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.409 ' HG2' HD22 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' ILE . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 11' ' ' LEU . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp . . . . . 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.67 ' HA ' HD23 ' A' ' 11' ' ' LEU . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.468 ' HG2' HD22 ' A' ' 11' ' ' LEU . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.427 ' O ' HG22 ' A' ' 24' ' ' ILE . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 18' ' ' LYS . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 20' ' ' ILE . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3305 ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3316 ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -61.97 146.19 50.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp -39.91 151.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 127.817 2.447 . . . . 0.0 115.375 -178.352 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' 3316 ' ' LEU . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.606 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.562 HG23 HD23 ' A' 3316 ' ' LEU . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.502 HD12 HD11 ' A' 3297 ' ' ILE . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HA ' HG22 ' A' ' 24' ' ' ILE . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.42 HG22 ' HA ' ' A' ' 21' ' ' LYS . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 51.29 19.78 0.82 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -125.66 -177.0 3.76 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.368 2.267 . . . . 0.0 111.35 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 m -127.32 -64.11 1.01 Allowed 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 126.337 1.855 . . . . 0.0 108.19 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.1 t -124.5 33.19 5.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.812 1.245 . . . . 0.0 111.499 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 58.43 34.75 24.23 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.99 -1.069 . . . . 0.0 112.777 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 168.36 2.25 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.386 1.075 . . . . 0.0 112.481 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -84.39 -69.48 0.64 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.17 -133.69 11.54 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 106.818 -2.513 . . . . 0.0 106.818 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 24.6 m -160.28 -30.17 0.06 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.357 1.079 . . . . 0.0 112.891 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.06 -176.52 16.94 Favored Glycine 0 CA--C 1.537 1.426 0 CA-C-N 119.924 1.238 . . . . 0.0 113.807 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 p -137.38 -179.22 5.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.239 2.216 . . . . 0.0 110.28 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 -164.59 10.66 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 126.381 1.944 . . . . 0.0 109.724 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.8 p -144.48 176.04 9.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.059 0.929 . . . . 0.0 112.322 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.49 24.41 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.033 1.778 . . . . 0.0 109.899 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 p -151.23 -173.87 4.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.737 1.215 . . . . 0.0 109.584 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -144.12 161.43 27.87 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -75.22 -45.42 40.45 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.887 1.275 . . . . 0.0 113.674 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.31 -165.07 52.9 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 -178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.1 p -155.38 157.59 37.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.829 0.852 . . . . 0.0 108.824 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.0 -155.47 38.69 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 t -154.82 163.31 40.46 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 159.12 -175.69 36.03 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.3 m -79.56 144.53 33.8 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -147.84 112.51 0.59 Allowed Glycine 0 C--N 1.332 0.318 0 N-CA-C 107.398 -2.281 . . . . 0.0 107.398 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 p -164.07 177.48 8.41 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.332 1.053 . . . . 0.0 108.706 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.51 162.5 33.54 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 125.814 1.674 . . . . 0.0 109.319 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 t -168.54 158.58 9.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.92 1.688 . . . . 0.0 106.7 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.37 154.69 25.7 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.204 1.383 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.6 p -162.43 179.82 7.52 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.708 0.803 . . . . 0.0 110.727 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.52 157.75 8.88 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 124.358 0.98 . . . . 0.0 112.698 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m -158.56 146.84 18.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.525 2.33 . . . . 0.0 106.139 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.1 -153.49 7.02 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -77.8 -137.07 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -66.51 159.71 26.66 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.577 -1.327 . . . . 0.0 110.205 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt -98.44 99.66 9.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.606 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 65.74 30.23 76.83 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.2 135.04 54.12 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 126.049 1.74 . . . . 0.0 110.855 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -86.63 99.11 11.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.267 0.627 . . . . 0.0 110.845 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.906 1.682 . . . . 0.0 107.746 177.069 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 CA--C 1.508 -0.662 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.94 147.44 34.16 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp -62.38 145.55 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.55 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.422 HG23 HD23 ' A' 3316 ' ' LEU . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 15' ' ' VAL . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.435 HD12 HD11 ' A' 3297 ' ' ILE . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' 3296 ' ' ASP . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t 56.61 20.24 4.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.408 ' C ' HD12 ' A' ' 28' ' ' LEU . 3.3 pp -134.76 177.13 8.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.904 1.681 . . . . 0.0 109.883 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 62.3 m -118.68 -48.07 2.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.558 1.143 . . . . 0.0 114.041 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.454 HG22 ' HE2' ' A' ' 32' ' ' LYS . 12.6 t -141.07 30.34 1.81 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.996 0.816 . . . . 0.0 110.966 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.256 14.5 mt-10 66.11 34.63 6.7 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 122.338 1.066 . . . . 0.0 110.844 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HE2' HG22 ' A' ' 30' ' ' THR . 15.3 mtmt -72.42 163.3 28.22 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -128.32 -68.12 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 96.54 -118.61 6.06 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.1 t -151.96 -99.81 0.06 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 77.59 82.89 0.57 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -137.85 18.53 2.85 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.323 1.449 . . . . 0.0 111.558 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -102.26 -97.73 2.37 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 t 57.48 -1.16 0.07 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.754 2.021 . . . . 0.0 115.946 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -102.79 43.33 1.7 Allowed Glycine 0 CA--C 1.524 0.622 0 CA-C-N 120.474 1.488 . . . . 0.0 111.06 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.2 m -156.84 172.12 19.2 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.697 1.199 . . . . 0.0 109.092 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -68.79 130.5 25.35 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 108.462 -1.855 . . . . 0.0 108.462 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.2 p -59.55 152.0 23.07 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.226 0.513 . . . . 0.0 109.784 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.85 36.69 0.9 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.263 1.411 . . . . 0.0 110.409 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.4 m -66.75 173.48 3.49 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.173 1.789 . . . . 0.0 111.409 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -153.49 150.57 22.29 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.1 m -89.08 -175.37 4.79 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.082 1.353 . . . . 0.0 112.269 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.69 -169.39 13.61 Favored Glycine 0 CA--C 1.531 1.077 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.6 t -167.0 134.87 2.56 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.839 1.319 . . . . 0.0 112.92 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.98 16.84 27.67 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.167 1.365 . . . . 0.0 110.522 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.0 p 51.84 24.29 2.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.068 2.547 . . . . 0.0 114.911 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -121.13 172.93 15.38 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 125.723 1.63 . . . . 0.0 110.441 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.1 t -153.97 101.38 2.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.1 177.42 32.34 Favored Glycine 0 CA--C 1.521 0.441 0 O-C-N 121.721 -0.612 . . . . 0.0 111.934 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.1 m -144.82 174.17 11.22 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.752 1.621 . . . . 0.0 108.736 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.45 160.14 27.85 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.1 m -139.86 177.69 7.78 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.384 1.074 . . . . 0.0 109.864 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 121.49 -136.47 11.13 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -84.32 5.07 28.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.256 1.028 . . . . 0.0 111.807 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -81.54 149.48 28.65 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt -74.55 101.79 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3296 ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.435 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.433 HD22 HD11 ' A' 3316 ' ' LEU . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.55 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 64.18 40.16 97.77 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.34 176.75 7.19 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.841 1.256 . . . . 0.0 111.35 -178.149 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -90.29 14.77 11.86 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.336 1.855 . . . . 0.0 113.691 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.992 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 mmt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -62.43 129.85 42.55 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.165 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt -65.42 140.73 19.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.446 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.534 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.434 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.434 HG22 ' O ' ' A' ' 20' ' ' ILE . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t 52.8 20.5 1.62 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 pp -124.92 175.15 7.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.918 1.687 . . . . 0.0 110.377 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.9 m -112.86 -45.15 3.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 113.321 -1.763 . . . . 0.0 111.564 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -162.94 43.11 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.15 28.69 16.04 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.875 -1.141 . . . . 0.0 109.066 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.73 106.84 5.65 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 103.844 -2.65 . . . . 0.0 103.844 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.4 172.56 6.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 123.003 0.521 . . . . 0.0 111.747 -178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 160.75 153.63 7.05 Favored Glycine 0 CA--C 1.525 0.684 0 C-N-CA 124.751 1.167 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.6 m -142.46 173.21 11.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.262 1.425 . . . . 0.0 109.239 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.24 178.6 48.6 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 p -139.4 169.13 18.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.606 1.162 . . . . 0.0 111.204 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.05 146.58 16.13 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 109.101 -1.599 . . . . 0.0 109.101 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -128.36 174.97 8.86 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.483 1.513 . . . . 0.0 109.119 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -158.68 179.67 34.17 Favored Glycine 0 CA--C 1.521 0.452 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.8 m -155.98 154.79 31.66 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.559 -0.965 . . . . 0.0 109.461 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.24 169.76 52.81 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -156.63 161.44 39.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.62 101.09 0.16 Allowed Glycine 0 C--O 1.226 -0.345 0 N-CA-C 108.371 -1.892 . . . . 0.0 108.371 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.3 t -165.98 -177.27 4.14 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.151 1.78 . . . . 0.0 106.772 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.65 -170.62 54.87 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 m -149.72 -12.45 0.28 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.36 38.69 0.26 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 119.514 1.052 . . . . 0.0 111.541 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.2 m -58.44 -20.18 42.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.951 1.701 . . . . 0.0 115.351 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.78 179.63 51.69 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-N 119.517 1.053 . . . . 0.0 110.539 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.2 p -142.57 174.85 10.27 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.279 1.831 . . . . 0.0 109.187 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.73 167.48 28.17 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.2 m -121.58 -13.64 8.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 79.17 -173.42 55.3 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -136.14 -160.47 1.06 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.588 1.155 . . . . 0.0 110.491 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.75 88.63 1.94 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.3 t -131.66 -27.0 1.96 Allowed 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.79 1.034 . . . . 0.0 113.79 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.07 -71.34 0.03 OUTLIER Glycine 0 C--N 1.335 0.481 0 N-CA-C 110.337 -1.105 . . . . 0.0 110.337 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -68.15 -178.69 1.09 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.017 0.909 . . . . 0.0 110.574 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -54.74 161.05 1.66 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 123.548 0.739 . . . . 0.0 112.146 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt -109.13 90.56 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 114.07 -45.19 1.35 Allowed Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.16 167.65 29.23 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 119.276 1.538 . . . . 0.0 112.817 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -163.96 87.26 0.5 Allowed 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 126.736 2.014 . . . . 0.0 108.107 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 29.2 mp0 . . . . . 0 C--O 1.245 0.85 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.404 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.011 -0.995 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -60.35 100.63 0.1 Allowed 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.35 137.68 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 125.674 1.59 . . . . 0.0 109.589 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 HD21 ' A' 3316 ' ' LEU . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.574 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 13' ' ' GLN . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.447 ' C ' ' H ' ' A' ' 28' ' ' LEU . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t 70.35 -33.2 0.26 Allowed 'General case' 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -73.75 180.0 3.92 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 128.383 2.673 . . . . 0.0 111.505 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.0 m -132.14 -26.86 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -165.29 29.71 0.06 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.043 0.937 . . . . 0.0 108.509 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 58.84 27.18 15.76 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.44 1.096 . . . . 0.0 112.436 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.11 38.78 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.225 2.61 . . . . 0.0 115.558 -178.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -64.61 -74.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.395 1.452 . . . . 0.0 110.591 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.09 -44.44 2.62 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.995 1.284 . . . . 0.0 114.5 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.7 p -145.82 -176.88 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.811 1.306 . . . . 0.0 111.009 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -172.14 171.93 44.49 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.911 1.72 . . . . 0.0 109.379 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.6 p -156.51 177.14 11.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.762 1.625 . . . . 0.0 110.162 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.95 -172.93 19.79 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.364 0.983 . . . . 0.0 113.551 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.4 t -81.68 -115.37 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.84 2.456 . . . . 0.0 109.359 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -168.24 166.15 39.3 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 127.127 2.299 . . . . 0.0 108.196 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.1 t -71.75 -30.48 65.63 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.61 -171.43 29.9 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -178.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.5 t -168.65 170.98 9.08 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.503 1.921 . . . . 0.0 106.693 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 162.99 171.25 28.99 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.5 p -162.91 174.71 12.02 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.578 1.151 . . . . 0.0 108.79 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.77 166.03 10.87 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 t -77.74 0.39 23.78 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.26 82.49 0.25 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.587 -1.805 . . . . 0.0 108.587 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 t -69.11 -2.68 10.83 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.47 -178.53 10.77 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.625 1.107 . . . . 0.0 111.454 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.8 p -152.15 173.98 14.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.059 0.944 . . . . 0.0 108.491 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.77 155.89 16.41 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.001 -2.44 . . . . 0.0 107.001 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.3 m -164.57 169.29 17.24 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.09 0.956 . . . . 0.0 109.124 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.46 132.74 2.65 Favored Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -164.23 150.19 10.85 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.301 1.84 . . . . 0.0 108.081 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.66 165.16 18.0 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 123.879 0.752 . . . . 0.0 111.313 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 t -148.29 -96.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.35 -65.67 0.27 Allowed Glycine 0 C--N 1.334 0.44 0 N-CA-C 108.151 -1.98 . . . . 0.0 108.151 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -71.1 -178.73 2.08 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.527 0.664 . . . . 0.0 110.636 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -57.62 162.32 3.09 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.337 0.589 . . . . 0.0 110.18 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt -92.96 98.28 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3301 ' ' GLN . . . . . 0.405 ' CB ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.624 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 72.4 53.47 8.75 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.59 -149.5 0.3 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.491 1.116 . . . . 0.0 111.595 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -141.43 27.01 1.92 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.784 2.033 . . . . 0.0 111.999 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 115.715 -2.088 . . . . 0.0 108.709 178.793 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 118.09 -0.957 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -76.62 119.92 21.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt -52.52 132.51 14.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 C-N-CA 124.501 1.12 . . . . 0.0 110.464 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.516 HG23 HD23 ' A' 3316 ' ' LEU . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.408 ' HB3' HD12 ' A' 3304 ' ' LEU . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.434 HD12 ' CD1' ' A' 3297 ' ' ILE . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.21 2.0 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.61 -170.84 1.92 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.446 2.298 . . . . 0.0 111.474 -179.44 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.7 m -131.9 -51.34 0.97 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 127.919 2.488 . . . . 0.0 107.504 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -150.91 37.83 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.965 1.306 . . . . 0.0 108.608 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 66.2 13.0 8.93 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.797 1.639 . . . . 0.0 113.733 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.96 -74.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.879 2.072 . . . . 0.0 115.39 -178.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -164.02 173.61 12.36 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.788 0.722 . . . . 0.0 109.392 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.23 -177.72 16.07 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.325 2.393 . . . . 0.0 108.788 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.7 t -165.22 160.91 18.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.111 1.456 . . . . 0.0 109.058 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.41 179.87 32.84 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.503 2.001 . . . . 0.0 109.657 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.29 169.13 16.23 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.758 1.223 . . . . 0.0 108.408 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.15 164.58 24.79 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -105.16 -130.5 0.28 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.736 1.268 . . . . 0.0 111.439 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 162.49 -107.92 0.33 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 107.854 -2.098 . . . . 0.0 107.854 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.7 p 56.0 7.69 0.31 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.248 1.819 . . . . 0.0 115.901 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.57 140.35 44.46 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.8 t -158.14 179.83 8.8 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.529 1.132 . . . . 0.0 108.262 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.02 162.88 33.62 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 108.903 -1.679 . . . . 0.0 108.903 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.6 m -158.18 79.57 0.83 Allowed 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.93 -36.94 0.9 Allowed Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.864 1.221 . . . . 0.0 113.704 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -73.36 178.32 4.64 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.372 1.469 . . . . 0.0 110.12 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -79.36 -148.45 4.57 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 125.235 1.398 . . . . 0.0 110.516 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 t -138.3 176.89 8.3 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.675 0.79 . . . . 0.0 109.628 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.47 171.76 42.75 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.9 t -159.87 -179.59 7.96 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.105 1.762 . . . . 0.0 106.269 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.09 152.07 10.23 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.044 -1.623 . . . . 0.0 109.044 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 t -150.82 -174.23 4.72 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.807 1.243 . . . . 0.0 108.843 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.82 178.08 34.49 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.9 t -162.66 -174.68 4.07 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.327 1.451 . . . . 0.0 107.8 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.73 174.44 35.11 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 126.747 2.118 . . . . 0.0 108.501 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -165.8 173.51 10.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.388 1.475 . . . . 0.0 108.644 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.34 -137.31 7.76 Favored Glycine 0 C--O 1.239 0.43 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -63.19 -177.9 0.21 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.599 1.559 . . . . 0.0 110.915 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -56.88 153.68 10.59 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.076 0.95 . . . . 0.0 110.828 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt -93.74 91.4 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.434 ' CD1' HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3304 ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 16' ' ' LEU . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3305 ' ' GLU . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.628 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.76 64.33 2.74 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -136.52 -157.85 0.82 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -143.54 35.18 1.3 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.725 2.01 . . . . 0.0 112.463 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 116.158 -1.877 . . . . 0.0 112.318 -179.031 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 116.964 -1.493 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -65.51 92.95 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.706 1.139 . . . . 0.0 110.343 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt -154.04 149.22 12.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 124.925 1.29 . . . . 0.0 107.913 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.42 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t 48.86 29.53 2.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 pp -138.32 -177.67 4.95 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.803 2.441 . . . . 0.0 108.361 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.4 m -126.7 -53.92 1.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.787 1.235 . . . . 0.0 110.608 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.252 3.6 t -136.48 32.66 2.79 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 64.61 4.37 2.29 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 127.962 2.505 . . . . 0.0 115.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -21.7 -73.49 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 128.085 2.554 . . . . 0.0 113.653 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -148.84 44.65 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.49 -117.53 9.51 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.2 t -124.77 -62.69 1.22 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.197 1.399 . . . . 0.0 110.845 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 175.9 177.13 44.69 Favored Glycine 0 CA--C 1.526 0.719 0 O-C-N 120.824 -1.172 . . . . 0.0 111.82 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -73.59 -77.48 0.11 Allowed 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.271 1.028 . . . . 0.0 113.606 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.05 -123.2 1.15 Allowed Glycine 0 C--N 1.336 0.534 0 O-C-N 121.024 -1.048 . . . . 0.0 111.386 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 p -158.3 -168.57 2.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.384 1.074 . . . . 0.0 109.896 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -125.08 178.48 16.52 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.954 2.216 . . . . 0.0 108.693 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.5 m -103.17 -167.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 125.162 1.385 . . . . 0.0 109.596 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.57 154.73 25.73 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 107.179 -2.368 . . . . 0.0 107.179 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p -76.08 -69.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.215 1.006 . . . . 0.0 110.024 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 155.98 178.2 29.93 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.7 p -121.69 5.36 10.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.415 1.486 . . . . 0.0 112.346 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.55 -177.92 39.86 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 p -135.88 -175.5 3.99 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.705 1.602 . . . . 0.0 109.191 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 53.86 30.22 44.24 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 123.966 0.793 . . . . 0.0 113.835 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.3 p -139.67 -78.18 0.32 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.711 1.204 . . . . 0.0 108.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.34 -175.11 23.49 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 123.587 0.613 . . . . 0.0 111.66 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -154.38 158.06 39.49 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 125.518 1.527 . . . . 0.0 107.856 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.78 96.23 0.12 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 38.1 m -137.4 162.72 32.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.239 1.816 . . . . 0.0 108.959 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.22 -164.57 33.44 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t 77.94 170.31 0.21 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.993 2.117 . . . . 0.0 111.067 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 115.1 121.14 3.44 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.51 -2.236 . . . . 0.0 107.51 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.3 p -153.68 158.82 41.62 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 117.695 0.748 . . . . 0.0 110.214 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 151.84 -112.85 0.55 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 126.21 1.862 . . . . 0.0 109.076 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -67.65 -168.97 0.1 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.029 1.331 . . . . 0.0 113.176 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -62.73 178.53 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.499 1.52 . . . . 0.0 110.735 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt -104.93 95.51 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.78 5.43 88.52 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -87.35 -166.77 1.67 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.048 2.139 . . . . 0.0 108.191 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -123.71 19.8 9.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.704 1.602 . . . . 0.0 111.695 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 58.2 mm-40 . . . . . 0 C--O 1.248 1.022 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 178.818 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.467 0.424 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.42 27.25 3.43 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.712 0.405 . . . . 0.0 111.276 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -155.7 168.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.591 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 HD23 ' A' 3316 ' ' LEU . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t 51.48 29.81 5.71 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.12 -173.47 3.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.41 1.884 . . . . 0.0 111.1 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -125.77 -70.81 0.72 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.63 1.572 . . . . 0.0 108.091 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -119.41 34.69 5.12 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.721 1.609 . . . . 0.0 111.427 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 57.49 36.75 27.3 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 148.83 11.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.306 0.643 . . . . 0.0 110.771 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -82.17 171.01 14.79 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.753 0.821 . . . . 0.0 108.807 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.84 106.57 2.65 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 124.844 1.212 . . . . 0.0 112.58 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 t -140.63 -7.95 1.1 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.919 1.688 . . . . 0.0 111.602 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -70.7 129.47 19.12 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 t -175.96 -169.48 0.33 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.781 2.432 . . . . 0.0 107.227 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.85 111.99 3.2 Favored Glycine 0 C--N 1.332 0.335 0 N-CA-C 108.388 -1.885 . . . . 0.0 108.388 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.4 m -140.45 158.04 44.6 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.678 0.791 . . . . 0.0 108.869 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.44 173.37 40.39 Favored Glycine 0 CA--C 1.519 0.305 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.4 t -147.67 -50.35 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.378 1.071 . . . . 0.0 108.909 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.26 -58.81 4.02 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p 57.73 -1.83 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.747 2.419 . . . . 0.0 116.331 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.96 169.3 39.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.7 t -168.54 -173.65 1.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.658 1.983 . . . . 0.0 106.576 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.01 15.07 79.91 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.257 -0.746 . . . . 0.0 114.051 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 t -150.17 169.86 20.31 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.97 1.385 . . . . 0.0 108.883 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.04 143.6 13.26 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.7 p -160.6 101.35 1.33 Allowed 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.818 -0.813 . . . . 0.0 109.506 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.77 170.69 26.84 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 178.16 0.74 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.666 2.386 . . . . 0.0 107.728 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.58 -171.05 43.07 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 125.677 1.608 . . . . 0.0 110.421 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.4 p -162.8 157.07 20.99 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.017 1.727 . . . . 0.0 108.426 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -136.37 157.65 23.64 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 108.178 -1.969 . . . . 0.0 108.178 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t -134.23 -164.55 1.52 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.036 1.334 . . . . 0.0 110.698 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.22 161.0 30.94 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.646 1.593 . . . . 0.0 109.6 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.6 t -160.47 -175.9 5.28 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.6 1.56 . . . . 0.0 108.239 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.62 -94.77 0.43 Allowed Glycine 0 C--N 1.336 0.581 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.401 ' H ' ' HD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -84.08 176.63 8.68 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 126.381 1.872 . . . . 0.0 109.994 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -77.84 175.78 9.68 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.23 -0.919 . . . . 0.0 111.19 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt -74.07 93.94 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 125.551 1.541 . . . . 0.0 109.975 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.591 HD21 HD12 ' A' ' 11' ' ' LEU . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.81 56.83 22.02 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.05 177.88 7.92 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.399 2.28 . . . . 0.0 110.964 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -128.18 90.64 3.12 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.7 pp0? . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.801 177.836 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.055 -0.497 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -70.19 12.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.145 1.778 . . . . 0.0 112.314 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp -164.15 168.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 127.984 2.513 . . . . 0.0 107.069 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.437 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.541 ' HA ' HD23 ' A' ' 11' ' ' LEU . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.464 ' HG2' HD22 ' A' ' 11' ' ' LEU . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.599 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.582 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.533 HG23 HD23 ' A' 3316 ' ' LEU . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.31 41.92 6.75 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.628 HD13 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -153.07 177.32 10.93 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.49 1.516 . . . . 0.0 108.1 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -112.76 -70.48 0.8 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.459 1.104 . . . . 0.0 110.023 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.0 t -125.92 51.75 1.73 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.91 1.684 . . . . 0.0 110.686 -177.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.628 ' H ' HD13 ' A' ' 28' ' ' LEU . 92.6 mt-10 54.81 43.7 29.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.99 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 179.52 1.04 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -145.7 172.58 13.08 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 120.92 -1.113 . . . . 0.0 109.758 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.69 106.75 0.77 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.9 t -128.85 -179.2 4.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.664 1.986 . . . . 0.0 109.594 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.72 137.99 10.06 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.92 1.248 . . . . 0.0 110.455 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -142.59 179.97 6.66 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.729 2.012 . . . . 0.0 108.275 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.61 172.97 21.06 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -148.45 175.23 11.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.326 1.451 . . . . 0.0 107.265 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.2 -168.63 39.98 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.034 -1.626 . . . . 0.0 109.034 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.7 t -148.86 153.74 38.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 150.19 165.11 12.32 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.686 1.136 . . . . 0.0 110.325 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.0 p -81.34 117.3 21.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.205 1.002 . . . . 0.0 110.057 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.01 -97.51 0.17 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.26 -0.4 0.66 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.402 1.881 . . . . 0.0 115.26 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.46 147.76 50.12 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 119.276 0.944 . . . . 0.0 110.847 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 p 179.63 165.33 1.09 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.327 2.651 . . . . 0.0 107.082 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 177.61 -172.1 44.8 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 p -153.42 -56.98 0.12 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.174 0.989 . . . . 0.0 110.698 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.06 177.73 47.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 126.692 2.092 . . . . 0.0 109.458 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.2 p -147.55 173.88 12.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.409 1.884 . . . . 0.0 107.075 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -159.29 -163.67 13.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.6 m -152.85 140.75 20.16 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.983 -1.304 . . . . 0.0 109.544 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -165.96 162.69 36.18 Favored Glycine 0 C--O 1.24 0.523 0 C-N-CA 125.211 1.386 . . . . 0.0 110.116 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.6 t -102.88 145.02 30.43 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -114.02 175.03 15.99 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 125.39 1.472 . . . . 0.0 109.92 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 p -156.03 151.7 27.19 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 67.77 -166.8 42.71 Favored Glycine 0 CA--C 1.524 0.636 0 CA-C-O 122.149 0.86 . . . . 0.0 113.018 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -68.86 33.16 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 127.56 2.344 . . . . 0.0 114.791 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -77.55 -175.83 3.99 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 120.71 -1.244 . . . . 0.0 111.238 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt -117.37 88.7 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 125.376 1.47 . . . . 0.0 107.459 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.599 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.55 11.07 85.66 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.27 -174.03 2.83 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.61 1.964 . . . . 0.0 111.141 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -129.82 32.24 4.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.753 1.621 . . . . 0.0 112.887 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.238 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mmm . . . . . 0 N--CA 1.478 0.948 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -59.02 161.73 4.83 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.852 1.261 . . . . 0.0 112.749 -178.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt -56.05 124.01 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.456 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.599 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 HD23 ' A' 3316 ' ' LEU . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 48.98 26.28 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.815 HD13 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -139.48 161.37 37.64 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 126.143 1.777 . . . . 0.0 108.008 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.7 m -91.25 -42.59 10.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.391 1.476 . . . . 0.0 113.042 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -163.48 38.43 0.09 Allowed 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.462 1.125 . . . . 0.0 108.423 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.815 ' H ' HD13 ' A' ' 28' ' ' LEU . 32.7 mt-10 68.99 13.4 8.79 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.083 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.94 146.7 5.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 128.214 2.605 . . . . 0.0 109.481 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 50.86 26.48 2.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.726 1.21 . . . . 0.0 113.269 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -45.1 108.87 0.23 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.809 1.671 . . . . 0.0 113.194 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 58.24 15.63 3.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.435 1.494 . . . . 0.0 112.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -92.53 148.59 19.18 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 120.75 -1.219 . . . . 0.0 112.336 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 p -147.83 -103.62 0.09 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.79 -157.86 45.02 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.85 0.75 . . . . 0.0 111.507 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.1 m -74.52 -179.43 4.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.227 1.011 . . . . 0.0 111.049 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -119.75 159.45 14.87 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.201 -1.96 . . . . 0.0 108.201 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.1 t -147.66 -1.1 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.269 1.028 . . . . 0.0 113.041 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 161.74 -12.82 0.13 Allowed Glycine 0 CA--C 1.533 1.173 0 CA-C-N 120.476 1.489 . . . . 0.0 115.348 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 p 46.31 28.96 0.77 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.307 2.243 . . . . 0.0 116.238 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.7 148.42 49.49 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.3 m -158.87 -6.83 0.07 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.576 1.15 . . . . 0.0 113.823 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.03 -164.41 31.1 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 120.22 1.373 . . . . 0.0 110.135 -179.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 165.8 26.88 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.369 1.067 . . . . 0.0 108.6 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.5 35.43 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.365 1.459 . . . . 0.0 113.585 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 58.2 m -147.64 -170.01 3.46 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.202 2.601 . . . . 0.0 108.651 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 176.97 -86.94 0.07 OUTLIER Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 t 45.91 81.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.558 2.343 . . . . 0.0 111.896 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.01 171.68 16.39 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.7 m -68.43 -48.74 63.81 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.544 1.138 . . . . 0.0 112.543 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.22 152.01 7.78 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.6 p -86.07 -176.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.329 1.452 . . . . 0.0 112.007 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -161.98 -178.77 36.16 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 129.029 3.204 . . . . 0.0 105.864 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 80.5 p -84.39 164.94 18.6 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 118.588 1.194 . . . . 0.0 111.433 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.46 164.1 27.75 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 109.155 -1.578 . . . . 0.0 109.155 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -74.4 -4.97 39.7 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.908 -0.76 . . . . 0.0 112.971 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -71.4 172.35 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.124 -0.985 . . . . 0.0 112.789 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt -79.47 102.89 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.671 1.588 . . . . 0.0 108.229 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3301 ' ' GLN . . . . . 0.419 ' HA ' HD13 ' A' 3304 ' ' LEU . 0.0 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3303 ' ' GLU . . . . . 0.486 ' HG2' HD12 ' A' 3304 ' ' LEU . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3304 ' ' LEU . . . . . 0.486 HD12 ' HG2' ' A' 3303 ' ' GLU . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.599 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 56.98 48.9 75.51 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -139.17 -178.01 5.16 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.883 2.073 . . . . 0.0 108.691 -178.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -135.86 82.76 1.97 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -83.44 45.63 1.07 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 121.097 1.771 . . . . 0.0 110.996 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp -159.82 171.16 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 125.207 1.403 . . . . 0.0 107.796 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.666 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.48 HG23 HD23 ' A' 3316 ' ' LEU . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.466 ' O ' HG22 ' A' ' 24' ' ' ILE . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 49.52 29.08 2.77 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.46 -178.27 5.43 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.538 1.935 . . . . 0.0 109.706 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.5 m -132.82 -35.32 1.09 Allowed 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.824 1.65 . . . . 0.0 112.338 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -154.18 33.28 0.43 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.455 1.502 . . . . 0.0 107.812 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 59.42 22.87 11.38 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.541 -1.349 . . . . 0.0 112.327 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -62.17 -32.25 72.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.554 1.942 . . . . 0.0 113.552 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -142.86 155.99 44.86 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.04 1.336 . . . . 0.0 108.71 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -175.83 -29.87 0.04 OUTLIER Glycine 0 CA--C 1.531 1.04 0 CA-C-O 118.451 -1.194 . . . . 0.0 114.299 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.6 m -61.3 159.82 11.71 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 119.437 1.618 . . . . 0.0 111.849 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 167.94 147.46 5.33 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.005 -1.238 . . . . 0.0 110.005 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 t -167.5 166.96 14.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 170.27 71.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 106.967 -2.453 . . . . 0.0 106.967 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.3 m -108.21 167.07 10.27 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.289 1.436 . . . . 0.0 109.985 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.28 -97.16 0.11 Allowed Glycine 0 C--N 1.332 0.335 0 N-CA-C 106.026 -2.83 . . . . 0.0 106.026 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.1 t -74.14 175.74 7.22 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.63 50.55 14.42 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 t -79.72 -172.75 3.47 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 -144.13 9.96 Favored Glycine 0 C--N 1.332 0.339 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.2 t -69.38 172.51 7.03 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.589 0.756 . . . . 0.0 110.592 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.99 -127.99 1.51 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -75.71 86.54 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -90.74 -2.48 72.28 Favored Glycine 0 CA--C 1.532 1.12 0 O-C-N 121.762 -0.587 . . . . 0.0 111.817 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.4 t 54.27 15.85 1.07 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.316 2.246 . . . . 0.0 113.382 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.89 -60.29 6.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 t 44.71 46.58 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.316 1.447 . . . . 0.0 110.78 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.53 -168.86 41.41 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 123.671 0.653 . . . . 0.0 111.879 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m 89.77 -8.82 0.38 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.488 3.115 . . . . 0.0 114.054 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.93 77.2 2.1 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.0 p -73.8 -57.08 4.22 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.755 0.777 . . . . 0.0 110.192 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.24 178.68 40.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.424 1.011 . . . . 0.0 112.261 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -143.04 163.6 32.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.319 1.847 . . . . 0.0 107.969 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -91.79 -22.04 32.03 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.274 -0.891 . . . . 0.0 114.672 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -117.58 159.59 22.65 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 124.084 0.954 . . . . 0.0 111.085 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -69.17 143.38 54.08 Favored 'General case' 0 C--O 1.231 0.079 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt -83.75 105.7 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3314 ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' 3320 ' ' GLN . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.666 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 76.9 59.31 3.21 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -140.27 -172.65 3.47 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.507 1.923 . . . . 0.0 108.566 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3320 ' ' GLN . . . . . 0.436 ' HB3' ' HB1' ' A' 3314 ' ' ALA . 25.8 tt0 54.88 69.48 0.73 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.781 2.032 . . . . 0.0 111.119 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.741 2.416 . . . . 0.0 111.727 179.379 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptt? . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.428 -0.796 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -85.73 43.98 1.08 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.535 1.516 . . . . 0.0 111.163 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.511 HG21 ' HB2' ' A' ' 6' ' ' GLN . 3.7 tp -165.34 172.52 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.709 1.203 . . . . 0.0 109.875 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.511 ' HB2' HG21 ' A' ' 3' ' ' ILE . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 11' ' ' LEU . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t 56.19 17.75 2.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -128.25 -176.11 3.71 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 125.901 1.681 . . . . 0.0 110.857 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.3 m -128.96 -43.19 1.35 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -148.5 23.22 1.02 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.992 0.901 . . . . 0.0 109.514 -178.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 60.19 39.25 19.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 110.884 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -32.68 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.03 0.932 . . . . 0.0 113.36 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 172.42 163.33 0.11 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 128.926 2.89 . . . . 0.0 110.27 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 126.83 2.64 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.3 p -147.13 -167.21 2.71 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.192 1.397 . . . . 0.0 109.047 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -170.21 176.95 43.74 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 107.444 -2.262 . . . . 0.0 107.444 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -144.99 178.08 8.29 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 117.919 0.859 . . . . 0.0 109.878 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.55 -155.35 31.24 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.503 1.525 . . . . 0.0 111.167 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.6 p -142.59 -172.8 3.71 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.098 1.359 . . . . 0.0 109.741 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.86 -177.45 14.9 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 125.764 1.649 . . . . 0.0 109.564 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.3 m -49.49 -53.39 23.47 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.186 1.394 . . . . 0.0 112.345 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 129.77 162.33 10.79 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 125.267 1.413 . . . . 0.0 110.52 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -175.93 137.32 0.33 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 128.59 2.756 . . . . 0.0 104.91 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.15 -171.09 14.58 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.363 0.982 . . . . 0.0 111.391 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.0 p -140.45 -93.99 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.454 1.102 . . . . 0.0 108.523 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 179.66 151.51 9.92 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 t -169.68 -33.25 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.648 1.179 . . . . 0.0 109.742 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 42.5 46.09 5.6 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 127.167 2.317 . . . . 0.0 114.204 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 t -83.06 -7.16 59.68 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -175.66 -89.61 0.08 OUTLIER Glycine 0 C--N 1.337 0.636 0 CA-C-N 121.058 1.754 . . . . 0.0 113.814 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m 52.72 26.3 4.37 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.618 1.167 . . . . 0.0 112.252 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.23 154.31 50.16 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.334 0.968 . . . . 0.0 113.839 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.6 m -73.9 177.41 5.6 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.405 1.082 . . . . 0.0 109.419 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.71 179.86 24.05 Favored Glycine 0 C--O 1.237 0.334 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 p -129.08 155.25 45.74 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.326 1.85 . . . . 0.0 108.03 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 58.16 -111.3 3.01 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 124.332 0.968 . . . . 0.0 111.442 -179.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -133.77 -27.23 1.5 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 126.514 1.926 . . . . 0.0 112.839 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 64.72 -132.64 37.63 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.301 0.955 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -87.35 -170.03 2.86 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.111 1.365 . . . . 0.0 108.936 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -60.85 158.93 12.06 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.628 -0.67 . . . . 0.0 110.37 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt -88.86 105.48 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3295 ' ' GLN . . . . . 0.551 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 75.64 63.82 2.38 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 6.5 t70 -138.63 -172.01 3.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.072 1.749 . . . . 0.0 110.575 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.41 70.06 1.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.451 1.9 . . . . 0.0 109.88 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 C--O 1.249 1.027 0 O-C-N 121.74 -0.6 . . . . 0.0 110.099 179.667 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.5 mtm . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -86.23 69.61 10.48 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.121 0.969 . . . . 0.0 110.668 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp -173.2 162.31 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 127.667 2.387 . . . . 0.0 108.839 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.454 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 11' ' ' LEU . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.482 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.422 HD12 HD11 ' A' 3297 ' ' ILE . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.01 26.11 9.59 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD22 ' HA ' ' A' ' 31' ' ' GLU . 3.1 pp -139.23 -169.47 2.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.565 1.146 . . . . 0.0 113.102 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -131.61 -28.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.5 t -156.98 19.99 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.97 0.805 . . . . 0.0 110.461 -177.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.581 ' HA ' HD22 ' A' ' 28' ' ' LEU . 20.7 mt-10 66.87 32.39 6.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.727 0.811 . . . . 0.0 109.018 -178.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 156.95 18.27 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -102.21 151.47 22.17 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 -152.75 9.8 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.411 1.005 . . . . 0.0 112.248 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.9 m -79.7 156.45 27.55 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.83 1.252 . . . . 0.0 108.424 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -177.77 171.04 43.6 Favored Glycine 0 C--N 1.334 0.469 0 O-C-N 120.626 -1.296 . . . . 0.0 112.453 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -70.66 157.66 37.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.601 1.56 . . . . 0.0 111.433 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.57 -164.69 0.14 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 129.191 3.281 . . . . 0.0 117.57 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.5 p -149.82 -172.27 4.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.336 1.855 . . . . 0.0 110.528 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -128.52 174.13 19.0 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.573 1.082 . . . . 0.0 113.061 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.4 m -128.33 -175.39 3.49 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.181 1.393 . . . . 0.0 111.737 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.1 -170.24 24.11 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.615 1.579 . . . . 0.0 112.474 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -164.43 174.15 11.32 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.434 1.893 . . . . 0.0 108.387 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.32 -167.19 14.97 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 128.69 3.043 . . . . 0.0 109.923 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.2 m -155.22 167.05 31.65 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.127 2.171 . . . . 0.0 108.506 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.74 175.18 43.84 Favored Glycine 0 CA--C 1.525 0.663 0 O-C-N 121.464 -0.773 . . . . 0.0 111.514 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.3 p -163.54 162.34 24.44 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 125.073 1.349 . . . . 0.0 110.05 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 143.04 151.55 5.5 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 m -139.4 160.05 40.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.611 1.164 . . . . 0.0 108.065 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.04 -160.75 28.43 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.8 p -109.51 112.13 24.04 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.974 0.909 . . . . 0.0 111.298 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.86 -65.3 0.12 Allowed Glycine 0 C--N 1.332 0.354 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 179.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 m 50.15 68.83 0.69 Allowed 'General case' 0 C--O 1.237 0.435 0 C-N-CA 126.399 1.879 . . . . 0.0 110.909 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.37 167.62 19.26 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.953 0.787 . . . . 0.0 113.238 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.6 t -138.18 177.05 8.17 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.459 2.303 . . . . 0.0 107.93 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -127.03 -129.0 3.2 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 106.361 -2.696 . . . . 0.0 106.361 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.7 p -159.56 170.55 21.4 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.375 1.588 . . . . 0.0 110.771 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -132.0 88.08 0.28 Allowed Glycine 0 C--N 1.335 0.515 0 C-N-CA 126.398 1.951 . . . . 0.0 109.344 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -127.08 -11.86 5.85 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.378 1.089 . . . . 0.0 113.68 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -86.31 -175.27 5.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.717 1.207 . . . . 0.0 111.395 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -84.64 98.91 6.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.422 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3305 ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.482 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 61.72 52.75 48.62 Favored Glycine 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.1 t0 -126.6 161.59 27.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.786 1.634 . . . . 0.0 111.063 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -145.69 30.84 1.08 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 123.973 0.909 . . . . 0.0 111.131 -178.825 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -77.48 -153.93 0.06 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 177.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp -72.8 166.0 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 11' ' ' LEU . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HG2' HD22 ' A' ' 11' ' ' LEU . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.536 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.52 HG23 HD23 ' A' 3316 ' ' LEU . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.426 ' O ' HG22 ' A' ' 24' ' ' ILE . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.01 30.18 3.92 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 pp -136.08 -177.32 4.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 125.738 1.615 . . . . 0.0 111.509 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 71.0 m -135.16 -40.25 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 128.907 2.883 . . . . 0.0 112.426 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.2 t -147.99 14.81 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.113 1.365 . . . . 0.0 110.171 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 69.59 47.76 0.64 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.591 -1.318 . . . . 0.0 109.127 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 163.33 28.28 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.662 1.585 . . . . 0.0 107.318 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -140.33 156.43 46.44 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.099 -1.001 . . . . 0.0 110.198 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 131.06 81.66 0.23 Allowed Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.3 t -126.93 155.85 42.43 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 109.566 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.18 156.51 32.33 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.763 1.649 . . . . 0.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -155.82 -49.76 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.21 -171.96 38.67 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m 60.18 -10.62 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.09 61.34 4.7 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.4 m -56.57 -10.76 1.06 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.45 2.3 . . . . 0.0 115.482 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.42 -23.38 73.48 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 119.577 1.08 . . . . 0.0 111.861 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.5 t 56.91 5.7 0.25 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.146 1.778 . . . . 0.0 114.81 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.88 -100.0 1.72 Allowed Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.691 1.587 . . . . 0.0 109.737 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.3 t 56.39 14.87 1.76 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -47.18 111.87 0.84 Allowed Glycine 0 C--N 1.339 0.707 0 C-N-CA 125.357 1.456 . . . . 0.0 112.123 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -127.64 156.54 42.15 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.069 1.347 . . . . 0.0 108.884 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 162.39 -115.03 0.63 Allowed Glycine 0 CA--C 1.521 0.449 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.3 m 65.37 85.48 0.14 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.253 1.821 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.21 158.76 25.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.6 m -159.61 166.1 31.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.347 1.459 . . . . 0.0 110.211 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.19 -140.46 2.9 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.25 -19.1 8.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.376 1.088 . . . . 0.0 111.86 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -175.07 166.42 38.03 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 119.987 1.267 . . . . 0.0 111.397 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -128.43 157.66 40.46 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.38 1.072 . . . . 0.0 109.547 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.567 ' H ' ' CG2' ' A' 3297 ' ' ILE . . . -54.19 148.74 18.95 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 125.074 1.321 . . . . 0.0 111.611 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -93.49 175.13 6.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.018 1.727 . . . . 0.0 113.684 -178.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.22 -171.1 51.61 Favored Glycine 0 CA--C 1.526 0.759 0 O-C-N 121.316 -0.865 . . . . 0.0 113.579 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -65.75 30.32 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.086 2.554 . . . . 0.0 115.08 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -82.25 174.82 10.8 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.147 -1.596 . . . . 0.0 107.794 177.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -101.36 94.86 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.147 0.979 . . . . 0.0 108.95 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.567 ' CG2' ' H ' ' A' ' 56' ' ' GLY . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.536 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 57.76 51.2 59.47 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 7.6 p30 -90.29 -168.19 2.04 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.227 1.411 . . . . 0.0 111.861 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.29 24.64 5.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 127.321 2.249 . . . . 0.0 113.13 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.574 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -133.99 38.3 3.19 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 122.221 2.282 . . . . 0.0 112.433 -177.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 6' ' ' GLN . 7.9 tt -163.78 162.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 O-C-N 121.579 -0.701 . . . . 0.0 111.1 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.524 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.407 ' HB3' HD12 ' A' 3304 ' ' LEU . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HA ' HG22 ' A' ' 24' ' ' ILE . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.437 HG22 ' HA ' ' A' ' 21' ' ' LYS . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.84 23.64 1.5 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -134.57 -174.45 3.58 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 127.473 2.309 . . . . 0.0 111.273 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 m -128.93 -40.51 1.51 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.093 1.757 . . . . 0.0 110.788 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -153.85 34.01 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.425 0.69 . . . . 0.0 110.016 -178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 58.97 31.57 21.47 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.25 -0.906 . . . . 0.0 112.102 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.48 141.87 11.52 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 124.944 1.298 . . . . 0.0 113.357 -178.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -58.32 -42.77 87.51 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.0 -155.02 43.93 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.16 -1.576 . . . . 0.0 109.16 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -151.16 -171.52 3.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.562 1.145 . . . . 0.0 109.712 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -153.77 -174.17 23.68 Favored Glycine 0 CA--C 1.527 0.794 0 C-N-CA 126.201 1.858 . . . . 0.0 108.907 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -141.75 -169.85 2.99 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.613 1.165 . . . . 0.0 109.062 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.26 -1.87 2.8 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 126.821 2.153 . . . . 0.0 111.38 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 p -144.21 -168.25 2.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.557 1.943 . . . . 0.0 107.82 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.69 -167.51 26.48 Favored Glycine 0 CA--C 1.532 1.128 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.9 p 51.17 75.87 0.18 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.7 1.6 . . . . 0.0 113.228 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.68 160.12 51.59 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.725 -1.75 . . . . 0.0 108.725 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.3 m -149.47 150.39 32.27 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.812 0.845 . . . . 0.0 109.768 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.05 13.37 Favored Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.759 1.171 . . . . 0.0 110.967 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.4 m -152.71 161.79 42.11 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 126.776 2.03 . . . . 0.0 107.848 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -162.66 162.01 34.17 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.3 t -157.96 150.72 22.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.409 1.084 . . . . 0.0 109.211 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 173.02 162.85 25.81 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 107.82 -2.112 . . . . 0.0 107.82 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.8 m -163.47 -84.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 125.748 1.619 . . . . 0.0 106.991 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.44 169.73 6.85 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 122.074 0.819 . . . . 0.0 112.053 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.3 t -132.0 140.15 48.85 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.188 1.395 . . . . 0.0 107.313 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.68 -168.22 20.42 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.751 0.691 . . . . 0.0 112.791 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -174.94 117.45 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.266 2.626 . . . . 0.0 105.802 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -156.39 36.14 0.59 Allowed Glycine 0 CA--C 1.524 0.597 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.491 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.3 m -64.04 173.11 2.01 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.135 0.967 . . . . 0.0 108.985 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.03 -165.31 25.34 Favored Glycine 0 CA--C 1.523 0.541 0 O-C-N 121.352 -0.842 . . . . 0.0 113.798 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.264 45.8 p 54.74 35.06 23.12 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.584 2.354 . . . . 0.0 113.034 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.77 -177.91 19.98 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -112.38 14.26 20.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.893 1.277 . . . . 0.0 108.741 179.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -66.26 155.75 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.761 2.424 . . . . 0.0 109.747 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt -72.9 98.85 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3298 ' ' GLU . . . . . 0.407 ' HA ' ' HG3' ' A' 3301 ' ' GLN . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3301 ' ' GLN . . . . . 0.407 ' HG3' ' HA ' ' A' 3298 ' ' GLU . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3304 ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 16' ' ' LEU . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3305 ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.64 57.87 16.75 Favored Glycine 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -145.47 -155.45 0.61 Allowed 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.137 0.975 . . . . 0.0 111.06 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -135.37 31.88 3.14 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.998 1.719 . . . . 0.0 110.933 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.415 0 C-N-CA 124.063 0.945 . . . . 0.0 109.518 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -140.21 13.47 2.41 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 120.673 -1.267 . . . . 0.0 112.274 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt -153.88 174.23 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 121.502 -0.749 . . . . 0.0 111.663 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.677 HD12 HD21 ' A' 3316 ' ' LEU . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.602 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.403 HD12 HD11 ' A' 3297 ' ' ILE . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 46.71 32.39 1.71 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -136.44 -175.28 3.95 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.556 1.542 . . . . 0.0 112.758 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -120.46 -43.54 2.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.51 1.924 . . . . 0.0 114.312 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.435 ' CG2' ' HE2' ' A' ' 32' ' ' LYS . 12.1 t -152.79 31.15 0.5 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.473 0.579 . . . . 0.0 111.062 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 61.72 32.36 18.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.257 0.623 . . . . 0.0 110.998 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HE2' ' CG2' ' A' ' 30' ' ' THR . 10.3 ttmm -70.88 170.88 11.69 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.541 1.137 . . . . 0.0 109.955 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.18 -177.86 3.15 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.997 0.903 . . . . 0.0 111.379 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.04 155.25 11.72 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 126.91 2.195 . . . . 0.0 108.588 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.7 t -175.8 137.65 0.35 Allowed 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.402 1.481 . . . . 0.0 110.065 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -136.9 172.31 22.66 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 127.679 2.561 . . . . 0.0 108.608 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -137.89 165.71 25.82 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.575 1.187 . . . . 0.0 109.705 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.0 171.49 30.0 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 124.535 1.064 . . . . 0.0 112.514 -179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.7 m -109.34 -96.9 0.39 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.53 -171.44 40.77 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 126.243 1.878 . . . . 0.0 108.492 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.9 m -140.45 171.54 14.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.145 1.378 . . . . 0.0 108.592 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.1 167.82 19.42 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.028 0.823 . . . . 0.0 111.126 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -77.02 163.73 26.41 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.095 1.358 . . . . 0.0 111.168 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -117.68 155.74 15.98 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.9 t -82.26 71.05 9.32 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.746 0.818 . . . . 0.0 109.325 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.77 -169.72 42.8 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.1 p -143.23 164.25 30.71 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 148.17 -169.16 28.89 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 107.403 -2.279 . . . . 0.0 107.403 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -158.02 165.56 34.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.046 0.923 . . . . 0.0 108.77 179.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 154.13 162.39 11.1 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.415 1.959 . . . . 0.0 108.349 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.4 t -173.31 161.92 4.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.38 1.872 . . . . 0.0 106.248 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 162.14 173.49 30.88 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-N 118.938 0.79 . . . . 0.0 112.858 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 m -172.5 162.46 5.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.937 2.495 . . . . 0.0 108.519 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -167.08 166.06 38.96 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.817 2.151 . . . . 0.0 109.027 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.7 m -160.04 172.61 17.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.917 1.687 . . . . 0.0 110.419 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.56 170.98 35.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.674 1.131 . . . . 0.0 110.948 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.0 p 151.67 145.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 130.429 3.492 . . . . 0.0 111.235 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -108.44 -65.17 0.57 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -88.35 -171.08 3.21 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.215 1.406 . . . . 0.0 109.504 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -57.7 155.82 9.47 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt -95.2 98.34 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.403 HD11 HD12 ' A' ' 20' ' ' ILE . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.677 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 81.15 44.01 8.36 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.8 t70 37.09 67.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 129.521 3.128 . . . . 0.0 113.146 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -148.98 31.16 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.531 1.132 . . . . 0.0 113.373 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 42.1 tp60 . . . . . 0 N--CA 1.435 -1.224 0 C-N-CA 126.298 1.839 . . . . 0.0 107.104 179.32 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -63.39 146.6 53.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 123.587 0.554 . . . . 0.0 109.767 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt -58.87 155.11 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 O-C-N 123.388 0.43 . . . . 0.0 110.72 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.438 HG23 HD23 ' A' 3316 ' ' LEU . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.485 HD12 HD11 ' A' 3297 ' ' ILE . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t 44.92 49.66 9.13 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -150.2 -174.34 4.7 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.346 1.07 . . . . 0.0 110.914 -178.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -124.61 -46.49 1.87 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 127.18 2.192 . . . . 0.0 111.364 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 33.33 0.4 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.864 0.866 . . . . 0.0 109.877 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 66.29 31.33 8.53 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 120.991 -1.068 . . . . 0.0 110.546 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -71.93 166.99 21.02 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -70.53 -52.89 18.63 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.354 -0.841 . . . . 0.0 109.1 178.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 46.19 66.92 1.5 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 126.009 1.766 . . . . 0.0 114.342 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.9 t -124.03 -172.17 2.48 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 124.201 1.001 . . . . 0.0 108.517 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.78 95.88 1.02 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 124.803 1.192 . . . . 0.0 111.47 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.9 m -144.8 165.14 28.96 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 108.734 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.0 103.18 0.17 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.8 p -150.86 175.26 12.2 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.584 1.192 . . . . 0.0 111.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.87 -68.56 0.01 OUTLIER Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 t 64.78 7.25 3.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.869 1.668 . . . . 0.0 115.031 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -160.42 165.33 34.9 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-N 120.654 1.57 . . . . 0.0 109.511 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.9 p -122.54 -22.02 5.55 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.995 1.318 . . . . 0.0 113.162 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.86 92.17 0.13 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 107.767 -2.133 . . . . 0.0 107.767 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -147.77 84.43 1.54 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 163.01 -170.8 38.62 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.8 t -153.17 -92.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.89 153.99 53.15 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 108.391 -1.883 . . . . 0.0 108.391 178.272 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 30.5 p -153.4 -176.83 5.98 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.608 1.163 . . . . 0.0 108.321 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.49 165.65 30.99 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.7 t -160.48 168.77 24.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.51 163.17 32.16 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t -147.18 -173.58 4.28 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -160.12 172.54 36.62 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 125.61 1.576 . . . . 0.0 109.528 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.2 t 176.59 179.98 0.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.751 2.82 . . . . 0.0 107.656 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 147.86 -167.32 28.8 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 p -118.39 156.76 28.41 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.55 -175.1 9.8 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.389 0.995 . . . . 0.0 110.728 -178.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 48.94 85.3 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.885 1.674 . . . . 0.0 112.016 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -59.4 157.29 11.36 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.188 0.595 . . . . 0.0 111.046 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt -97.03 89.62 2.11 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.485 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.438 HD23 HG23 ' A' ' 15' ' ' VAL . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.37 23.2 65.94 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.22 -164.68 0.96 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.143 1.777 . . . . 0.0 109.42 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -140.6 25.3 2.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.428 1.091 . . . . 0.0 112.717 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 5.9 pm0 . . . . . 0 C--O 1.246 0.92 0 C-N-CA 127.159 2.184 . . . . 0.0 107.844 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 ptm . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.84 115.96 12.76 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 103.12 -2.919 . . . . 0.0 103.12 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt -62.08 158.29 3.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' 3309 ' ' GLU . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.56 HD12 HD21 ' A' 3316 ' ' LEU . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.421 HG23 HD23 ' A' 3316 ' ' LEU . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' 3304 ' ' LEU . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.412 HD12 HD11 ' A' 3297 ' ' ILE . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t 45.29 42.2 6.99 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.483 HD13 ' H ' ' A' ' 31' ' ' GLU . 3.6 pp -147.72 -175.75 4.99 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.697 1.199 . . . . 0.0 111.007 -177.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 m -113.75 -51.22 2.8 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.513 1.525 . . . . 0.0 111.337 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -155.51 37.94 0.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 122.143 0.973 . . . . 0.0 109.537 -178.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.483 ' H ' HD13 ' A' ' 28' ' ' LEU . 20.2 mt-10 64.82 13.38 8.45 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.747 -1.221 . . . . 0.0 111.973 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.05 -68.33 0.18 Allowed 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.887 1.675 . . . . 0.0 111.086 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -167.25 166.42 14.8 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.727 0.811 . . . . 0.0 110.268 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -174.11 147.7 9.48 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 126.685 2.088 . . . . 0.0 108.36 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.1 m -167.06 177.8 6.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.969 1.708 . . . . 0.0 109.87 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -175.61 160.34 28.65 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.3 m -170.86 178.84 3.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.004 2.522 . . . . 0.0 107.874 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 105.57 0.27 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 t -143.66 171.1 14.65 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.775 1.23 . . . . 0.0 109.355 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.22 -34.39 3.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.836 1.208 . . . . 0.0 113.744 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 80.3 p -71.17 18.32 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.462 1.631 . . . . 0.0 114.453 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -107.59 82.36 0.31 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.584 -2.606 . . . . 0.0 106.584 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.7 m -147.64 162.36 39.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.039 1.336 . . . . 0.0 108.302 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.84 176.57 44.18 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.0 p -82.02 62.57 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.372 1.069 . . . . 0.0 108.524 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 130.13 -155.75 21.18 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.4 m -92.66 151.34 20.14 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.517 0.727 . . . . 0.0 110.61 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -80.43 113.13 3.58 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 108.345 -1.902 . . . . 0.0 108.345 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -75.7 2.87 10.89 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.814 1.245 . . . . 0.0 113.408 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -163.4 169.93 38.63 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.296 -1.521 . . . . 0.0 109.296 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.9 m -120.13 175.9 5.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.131 1.373 . . . . 0.0 111.413 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -96.19 168.64 25.88 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.3 m -143.43 143.5 31.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.73 171.67 24.11 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.5 m -153.49 -177.1 6.13 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.903 1.681 . . . . 0.0 108.564 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -131.21 -175.33 13.96 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.245 1.879 . . . . 0.0 109.911 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -127.28 -93.38 0.47 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.402 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.53 -75.58 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 120.179 1.354 . . . . 0.0 112.698 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -74.17 -161.88 0.13 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.761 1.224 . . . . 0.0 111.031 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -65.21 178.05 0.96 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.471 -0.768 . . . . 0.0 111.747 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt -113.42 92.08 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3297 ' ' ILE . . . . . 0.412 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3304 ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 16' ' ' LEU . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3305 ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.45 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.56 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.52 46.85 37.83 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.34 -170.27 2.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.727 1.611 . . . . 0.0 111.124 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -121.52 28.45 7.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.147 2.179 . . . . 0.0 110.604 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 . . . . . 0 C--O 1.241 0.653 0 C-N-CA 125.881 1.672 . . . . 0.0 109.883 -179.252 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -78.62 80.25 5.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt -153.44 156.62 5.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 126.219 1.807 . . . . 0.0 107.54 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HG2' HD22 ' A' ' 11' ' ' LEU . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.782 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.588 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.661 HG23 HD23 ' A' 3316 ' ' LEU . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HE2' HD21 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.9 0.7 0.12 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 pp -100.75 -177.9 3.61 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 128.172 2.589 . . . . 0.0 111.205 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.7 m -134.81 -41.45 0.76 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 125.646 1.578 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -157.92 37.0 0.26 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 53.98 31.49 13.6 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.302 1.049 . . . . 0.0 109.414 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -65.6 150.35 48.57 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.233 2.213 . . . . 0.0 109.283 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -131.81 170.14 15.25 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.227 1.011 . . . . 0.0 108.842 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 128.53 111.99 1.62 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 107.927 -2.069 . . . . 0.0 107.927 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 m -135.13 165.29 25.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.272 1.829 . . . . 0.0 108.524 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -174.7 -166.52 32.75 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 108.952 -1.659 . . . . 0.0 108.952 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.2 t -60.7 157.61 14.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.19 0.995 . . . . 0.0 108.96 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.36 -13.96 7.91 Favored Glycine 0 CA--C 1.524 0.63 0 CA-C-O 119.268 -0.74 . . . . 0.0 113.418 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -64.02 121.37 13.96 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.715 1.257 . . . . 0.0 109.405 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 149.96 -172.96 29.79 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 109.253 -1.539 . . . . 0.0 109.253 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 t -128.65 159.65 34.92 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.39 94.81 0.1 OUTLIER Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 106.236 -2.746 . . . . 0.0 106.236 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.2 m -58.71 -50.68 73.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.88 0.84 . . . . 0.0 110.969 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 149.5 -140.67 8.27 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -148.7 -40.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 117.662 0.731 . . . . 0.0 110.643 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.07 164.27 39.9 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.314 -1.115 . . . . 0.0 110.314 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -139.29 -1.44 1.72 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.424 1.09 . . . . 0.0 113.279 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 178.39 156.41 16.76 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-N 119.603 1.092 . . . . 0.0 110.72 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -75.22 -71.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.014 0.926 . . . . 0.0 109.813 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 165.4 -178.59 40.26 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 126.098 1.809 . . . . 0.0 109.581 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.8 t -154.19 -88.11 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 103.6 -2.741 . . . . 0.0 103.6 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.64 -171.18 36.2 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 108.354 -1.898 . . . . 0.0 108.354 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 m -118.28 3.96 11.93 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.696 -0.884 . . . . 0.0 112.976 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.31 178.65 9.08 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-O 122.257 0.921 . . . . 0.0 112.315 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -172.56 -138.84 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 104.548 -2.39 . . . . 0.0 104.548 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.9 179.73 16.5 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 125.371 1.462 . . . . 0.0 109.749 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.6 t -163.28 175.18 11.16 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.8 49.9 1.88 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 124.809 1.195 . . . . 0.0 111.333 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 51.16 39.0 22.52 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.234 1.414 . . . . 0.0 111.958 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -63.91 170.74 3.25 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.254 0.55 . . . . 0.0 111.755 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt -107.82 85.26 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3304 ' ' LEU . . . . . 0.481 HD21 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.782 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.9 t30 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.89 61.44 3.78 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 13.8 m-20 30.26 64.4 0.16 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.218 3.007 . . . . 0.0 111.591 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -147.11 68.82 1.15 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.521 1.528 . . . . 0.0 108.144 -178.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.826 1.251 . . . . 0.0 108.976 179.802 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mmt . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -62.53 128.25 35.12 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt -59.84 148.1 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.409 ' HG2' HD22 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' ILE . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t 55.0 16.94 1.66 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 pp -121.88 -172.55 2.46 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.813 2.045 . . . . 0.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.7 m -127.83 -45.48 1.44 Allowed 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 125.075 1.35 . . . . 0.0 112.912 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 t -152.67 31.63 0.51 Allowed 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 62.32 45.8 6.42 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -66.01 161.33 21.75 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 125.816 1.646 . . . . 0.0 111.636 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -115.19 -32.83 5.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.549 0.74 . . . . 0.0 110.541 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.6 136.19 47.45 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 107.745 -2.142 . . . . 0.0 107.745 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 p -140.87 -66.35 0.43 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.445 0.623 . . . . 0.0 112.006 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.54 157.29 21.59 Favored Glycine 0 CA--C 1.528 0.873 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 m -150.95 175.24 12.25 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.284 1.433 . . . . 0.0 108.062 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.46 149.36 9.33 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -160.15 155.89 25.79 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 46.85 19.4 0.52 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.756 2.122 . . . . 0.0 116.347 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.3 p -157.3 160.47 38.59 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.414 1.607 . . . . 0.0 109.496 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 166.92 147.99 5.44 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.3 m -150.79 43.31 0.81 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.349 1.074 . . . . 0.0 110.457 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.32 -141.95 15.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 t 68.52 32.6 4.32 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.164 1.386 . . . . 0.0 111.437 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.19 135.75 12.87 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 124.837 1.208 . . . . 0.0 111.469 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.0 p -155.66 177.71 11.08 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.103 0.961 . . . . 0.0 110.075 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.21 176.58 47.06 Favored Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.272 -1.531 . . . . 0.0 109.272 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.13 174.47 11.29 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 163.03 174.46 32.96 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 109.171 -1.571 . . . . 0.0 109.171 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.4 p -144.36 -169.39 3.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.64 -32.89 8.86 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.381 -1.233 . . . . 0.0 114.622 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.2 t -77.35 96.26 4.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.62 1.71 . . . . 0.0 110.438 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.47 120.93 1.21 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.5 p -138.81 -68.57 0.44 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.647 1.179 . . . . 0.0 111.474 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.29 -179.38 32.15 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.39 1.947 . . . . 0.0 110.131 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 m -154.21 124.02 6.72 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 120.56 -1.553 . . . . 0.0 108.651 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 104.11 176.51 25.48 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 109.124 -1.591 . . . . 0.0 109.124 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -72.37 43.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.859 1.664 . . . . 0.0 113.127 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -72.87 172.63 10.51 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.33 -0.856 . . . . 0.0 109.594 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt -84.14 104.71 12.78 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 11' ' ' LEU . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 73.91 33.64 57.19 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -127.84 176.59 7.45 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 128.048 2.539 . . . . 0.0 109.027 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -149.63 85.62 1.44 Allowed 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.109 177.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.7 mtm . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -64.66 143.25 58.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp -57.8 146.6 7.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.67 ' HA ' HD23 ' A' ' 11' ' ' LEU . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.468 ' HG2' HD22 ' A' ' 11' ' ' LEU . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.427 ' O ' HG22 ' A' ' 24' ' ' ILE . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 18' ' ' LYS . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 20' ' ' ILE . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.455 ' C ' ' H ' ' A' ' 28' ' ' LEU . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t 57.3 -8.36 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.455 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -94.91 179.57 5.18 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.139 2.976 . . . . 0.0 110.679 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.2 m -121.72 -61.58 1.49 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.475 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 t -136.98 36.06 2.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 109.186 -178.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 61.09 25.09 15.15 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.21 1.404 . . . . 0.0 111.118 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -69.91 121.16 16.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.261 2.624 . . . . 0.0 110.745 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -74.25 -34.57 63.65 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 123.849 0.718 . . . . 0.0 110.085 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.75 -101.19 1.9 Allowed Glycine 0 C--N 1.335 0.477 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.0 p -178.23 176.25 1.12 Allowed 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.994 1.318 . . . . 0.0 109.905 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 171.91 69.7 0.04 OUTLIER Glycine 0 C--N 1.334 0.45 0 CA-C-O 119.234 -0.759 . . . . 0.0 111.532 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.6 p -154.68 176.68 12.13 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.098 0.959 . . . . 0.0 109.421 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.71 -69.06 0.78 Allowed Glycine 0 C--N 1.337 0.594 0 N-CA-C 108.488 -1.845 . . . . 0.0 108.488 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -78.25 69.68 4.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.334 1.054 . . . . 0.0 109.388 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.7 -167.64 33.66 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 108.543 -1.823 . . . . 0.0 108.543 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.1 m -154.46 146.99 24.06 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 121.477 -1.014 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -175.44 177.71 47.24 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 127.993 2.711 . . . . 0.0 107.919 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.5 p -162.86 -167.45 1.53 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 117.901 0.851 . . . . 0.0 108.998 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -161.38 173.43 37.78 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.0 m -156.98 123.03 4.84 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.88 14.51 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t 45.02 45.26 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.938 2.095 . . . . 0.0 113.734 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.76 105.5 0.38 Allowed Glycine 0 C--N 1.337 0.62 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.9 t -124.33 -66.32 0.99 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.103 1.361 . . . . 0.0 108.575 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.56 176.27 47.08 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 125.114 1.34 . . . . 0.0 111.742 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 p -132.95 167.89 19.45 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.541 1.537 . . . . 0.0 109.027 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 130.43 -154.84 20.83 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.19 91.71 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.895 2.478 . . . . 0.0 106.643 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.53 163.34 9.65 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.134 0.852 . . . . 0.0 113.421 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.9 t -132.26 178.19 7.0 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.374 2.27 . . . . 0.0 108.422 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -110.98 179.06 19.9 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 126.093 1.806 . . . . 0.0 110.3 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -149.77 174.54 12.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.379 1.072 . . . . 0.0 109.776 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -135.55 -19.14 0.76 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.947 0.784 . . . . 0.0 112.97 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -88.3 4.73 44.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.749 1.274 . . . . 0.0 113.938 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -128.82 -173.9 3.1 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.037 2.135 . . . . 0.0 108.616 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt -102.25 93.07 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3305 ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3316 ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 68.68 54.43 15.3 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.03 108.45 0.67 Allowed 'General case' 0 C--O 1.232 0.173 0 C-N-CA 126.109 1.764 . . . . 0.0 109.525 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -146.86 91.7 2.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.364 -2.458 . . . . 0.0 104.364 -179.847 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp . . . . . 0 C--O 1.235 0.318 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' 3316 ' ' LEU . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.606 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.562 HG23 HD23 ' A' 3316 ' ' LEU . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.502 HD12 HD11 ' A' 3297 ' ' ILE . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HA ' HG22 ' A' ' 24' ' ' ILE . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.42 HG22 ' HA ' ' A' ' 21' ' ' LYS . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt . . . . . 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.401 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.606 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp . . . . . 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.55 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.422 HG23 HD23 ' A' 3316 ' ' LEU . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 15' ' ' VAL . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.435 HD12 HD11 ' A' 3297 ' ' ILE . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' 3296 ' ' ASP . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt . . . . . 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.435 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.433 HD22 HD11 ' A' 3316 ' ' LEU . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.55 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.446 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.534 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.434 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.434 HG22 ' O ' ' A' ' 20' ' ' ILE . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt . . . . . 0 C--O 1.233 0.227 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 HD21 ' A' 3316 ' ' LEU . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.574 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 13' ' ' GLN . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t . . . . . 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.405 ' CB ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.624 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt . . . . . 0 C--O 1.232 0.138 0 N-CA-C 110.464 -0.198 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.516 HG23 HD23 ' A' 3316 ' ' LEU . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.408 ' HB3' HD12 ' A' 3304 ' ' LEU . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.434 HD12 ' CD1' ' A' 3297 ' ' ILE . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.434 ' CD1' HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.453 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 16' ' ' LEU . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.628 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt . . . . . 0 C--O 1.238 0.497 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.42 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t . . . . . 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt . . . . . 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.468 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt . . . . . 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.591 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 HD23 ' A' 3316 ' ' LEU . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t . . . . . 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt . . . . . 0 CA--C 1.534 0.331 0 CA-C-O 121.167 0.508 . . . . 0.0 109.975 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.436 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.591 HD21 HD12 ' A' ' 11' ' ' LEU . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp . . . . . 0 N--CA 1.444 -0.754 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.437 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.541 ' HA ' HD23 ' A' ' 11' ' ' LEU . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.464 ' HG2' HD22 ' A' ' 11' ' ' LEU . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.599 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.582 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.533 HG23 HD23 ' A' 3316 ' ' LEU . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt . . . . . 0 CA--C 1.534 0.335 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.451 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.599 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt . . . . . 0 N--CA 1.448 -0.54 0 CA-C-O 123.405 1.574 . . . . 0.0 109.456 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.599 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 HD23 ' A' 3316 ' ' LEU . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t . . . . . 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.419 ' HA ' HD13 ' A' 3304 ' ' LEU . 0.0 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . 0.486 ' HG2' HD12 ' A' 3304 ' ' LEU . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . 0.486 HD12 ' HG2' ' A' 3303 ' ' GLU . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.599 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp . . . . . 0 C--O 1.231 0.08 0 N-CA-C 107.796 -1.187 . . . . 0.0 107.796 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.666 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.48 HG23 HD23 ' A' 3316 ' ' LEU . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.466 ' O ' HG22 ' A' ' 24' ' ' ILE . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt . . . . . 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.666 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.511 HG21 ' HB2' ' A' ' 6' ' ' GLN . 3.7 tp . . . . . 0 C--O 1.236 0.384 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.511 ' HB2' HG21 ' A' ' 3' ' ' ILE . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 11' ' ' LEU . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt . . . . . 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . 0.551 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp . . . . . 0 N--CA 1.469 0.483 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.454 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 11' ' ' LEU . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.482 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.422 HD12 HD11 ' A' 3297 ' ' ILE . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.422 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.414 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.482 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp . . . . . 0 N--CA 1.451 -0.421 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 11' ' ' LEU . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HG2' HD22 ' A' ' 11' ' ' LEU . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.536 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.52 HG23 HD23 ' A' 3316 ' ' LEU . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.426 ' O ' HG22 ' A' ' 24' ' ' ILE . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 122.025 0.917 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.536 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 6' ' ' GLN . 7.9 tt . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.544 0.211 . . . . 0.0 111.1 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.524 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.407 ' HB3' HD12 ' A' 3304 ' ' LEU . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HA ' HG22 ' A' ' 24' ' ' ILE . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.437 HG22 ' HA ' ' A' ' 21' ' ' LYS . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt . . . . . 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . 0.407 ' HA ' ' HG3' ' A' 3301 ' ' GLN . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.407 ' HG3' ' HA ' ' A' 3298 ' ' GLU . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 16' ' ' LEU . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt . . . . . 0 CA--C 1.528 0.116 0 CA-C-O 120.998 0.428 . . . . 0.0 111.663 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.677 HD12 HD21 ' A' 3316 ' ' LEU . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.602 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.403 HD12 HD11 ' A' 3297 ' ' ILE . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.403 HD11 HD12 ' A' ' 20' ' ' ILE . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.677 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.821 0.343 . . . . 0.0 110.72 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.438 HG23 HD23 ' A' 3316 ' ' LEU . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.485 HD12 HD11 ' A' 3297 ' ' ILE . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt . . . . . 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.485 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.438 HD23 HG23 ' A' ' 15' ' ' VAL . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt . . . . . 0 CA--C 1.531 0.237 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' 3309 ' ' GLU . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.56 HD12 HD21 ' A' 3316 ' ' LEU . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.421 HG23 HD23 ' A' 3316 ' ' LEU . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' 3304 ' ' LEU . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.412 HD12 HD11 ' A' 3297 ' ' ILE . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t . . . . . 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt . . . . . 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . 0.412 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 16' ' ' LEU . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.45 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.56 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HG2' HD22 ' A' ' 11' ' ' LEU . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.782 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.588 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.661 HG23 HD23 ' A' 3316 ' ' LEU . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HE2' HD21 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . 0.481 HD21 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.782 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.409 ' HG2' HD22 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' ILE . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . 0.414 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 11' ' ' LEU . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp . . . . . 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.67 ' HA ' HD23 ' A' ' 11' ' ' LEU . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.468 ' HG2' HD22 ' A' ' 11' ' ' LEU . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.427 ' O ' HG22 ' A' ' 24' ' ' ILE . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 18' ' ' LYS . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 20' ' ' ILE . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t . . . . . 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3305 ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3316 ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.8 mpp? . . . . . 0 N--CA 1.473 0.696 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -61.97 146.19 50.78 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 107.528 -1.286 . . . . 0.0 107.528 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.429 HG13 ' H ' ' A' ' 6' ' ' GLN . 9.5 tp -39.91 151.54 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 C-N-CA 127.817 2.447 . . . . 0.0 115.375 -178.352 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.57 -53.86 2.62 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 126.991 2.116 . . . . 0.0 109.281 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.17 -39.27 78.43 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.158 1.383 . . . . 0.0 113.967 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' HG13 ' A' ' 3' ' ' ILE . 58.0 mt-30 -77.37 -26.42 51.89 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.668 0.787 . . . . 0.0 109.791 178.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 88.6 m -71.0 -35.48 72.08 Favored 'General case' 0 N--CA 1.449 -0.525 0 O-C-N 120.834 -1.166 . . . . 0.0 109.686 179.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.4 mt -53.65 -29.89 40.52 Favored 'General case' 0 C--O 1.221 -0.443 0 C-N-CA 124.907 1.283 . . . . 0.0 108.483 -179.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.08 -40.18 63.89 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.793 1.237 . . . . 0.0 110.789 179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.95 -28.94 61.74 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 119.051 0.841 . . . . 0.0 110.589 179.302 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.555 HD12 HD21 ' A' 3316 ' ' LEU . 3.0 mm? -75.63 -54.72 6.52 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 124.534 1.134 . . . . 0.0 110.427 -179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.95 -43.09 77.13 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 120.432 -1.417 . . . . 0.0 111.524 -179.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.1 pp0? -65.98 -34.0 77.1 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 118.198 0.454 . . . . 0.0 109.955 178.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.606 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -67.74 -37.61 82.4 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 120.798 -1.189 . . . . 0.0 108.714 178.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.562 HG23 HD23 ' A' 3316 ' ' LEU . 97.1 t -73.52 -54.2 16.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 C-N-CA 123.848 0.859 . . . . 0.0 110.106 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pp -52.4 -32.51 39.29 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 119.77 1.168 . . . . 0.0 111.543 -178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -56.43 -37.68 70.55 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 117.839 -1.077 . . . . 0.0 110.98 178.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -37.74 66.02 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-N 121.193 1.815 . . . . 0.0 109.128 177.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 89.0 mttt -55.22 -33.36 63.03 Favored 'General case' 0 CA--C 1.519 -0.241 0 C-N-CA 123.545 0.738 . . . . 0.0 111.005 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.502 HD12 HD11 ' A' 3297 ' ' ILE . 4.6 mm -63.92 -39.76 86.6 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 119.356 0.98 . . . . 0.0 108.872 179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HA ' HG22 ' A' ' 24' ' ' ILE . 38.9 mtmt -72.17 -28.89 63.52 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 124.475 1.11 . . . . 0.0 110.17 178.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 99.7 mt-10 -73.08 -50.36 23.32 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.15 -0.969 . . . . 0.0 109.479 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.65 -40.05 95.88 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.033 179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.42 HG22 ' HA ' ' A' ' 21' ' ' LYS . 3.0 tt -70.07 -45.11 77.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.745 1.157 . . . . 0.0 110.884 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -75.41 -47.72 26.11 Favored 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -77.51 -51.05 11.36 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 -178.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 m 51.29 19.78 0.82 Allowed 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -125.66 -177.0 3.76 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 127.368 2.267 . . . . 0.0 111.35 -178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 22.6 m -127.32 -64.11 1.01 Allowed 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 126.337 1.855 . . . . 0.0 108.19 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.1 t -124.5 33.19 5.3 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.812 1.245 . . . . 0.0 111.499 -178.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 58.43 34.75 24.23 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.99 -1.069 . . . . 0.0 112.777 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.62 168.36 2.25 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.386 1.075 . . . . 0.0 112.481 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -84.39 -69.48 0.64 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 103.17 -133.69 11.54 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 106.818 -2.513 . . . . 0.0 106.818 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 24.6 m -160.28 -30.17 0.06 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.357 1.079 . . . . 0.0 112.891 178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.06 -176.52 16.94 Favored Glycine 0 CA--C 1.537 1.426 0 CA-C-N 119.924 1.238 . . . . 0.0 113.807 179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 p -137.38 -179.22 5.6 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.239 2.216 . . . . 0.0 110.28 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -134.3 -164.59 10.66 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 126.381 1.944 . . . . 0.0 109.724 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.8 p -144.48 176.04 9.68 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 118.059 0.929 . . . . 0.0 112.322 -179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -146.09 177.49 24.41 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.033 1.778 . . . . 0.0 109.899 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 26.4 p -151.23 -173.87 4.64 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.737 1.215 . . . . 0.0 109.584 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -144.12 161.43 27.87 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 108.653 -1.779 . . . . 0.0 108.653 179.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.6 p -75.22 -45.42 40.45 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.887 1.275 . . . . 0.0 113.674 -179.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 77.31 -165.07 52.9 Favored Glycine 0 CA--C 1.532 1.138 0 N-CA-C 109.317 -1.513 . . . . 0.0 109.317 -178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.1 p -155.38 157.59 37.32 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 123.829 0.852 . . . . 0.0 108.824 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.0 -155.47 38.69 Favored Glycine 0 CA--C 1.526 0.761 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 14.8 t -154.82 163.31 40.46 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 106.988 -1.486 . . . . 0.0 106.988 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 159.12 -175.69 36.03 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.3 m -79.56 144.53 33.8 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -147.84 112.51 0.59 Allowed Glycine 0 C--N 1.332 0.318 0 N-CA-C 107.398 -2.281 . . . . 0.0 107.398 179.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 22.6 p -164.07 177.48 8.41 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.332 1.053 . . . . 0.0 108.706 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -173.51 162.5 33.54 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 125.814 1.674 . . . . 0.0 109.319 179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 19.3 t -168.54 158.58 9.56 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.92 1.688 . . . . 0.0 106.7 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.37 154.69 25.7 Favored Glycine 0 CA--C 1.53 1.014 0 C-N-CA 125.204 1.383 . . . . 0.0 110.342 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 66.6 p -162.43 179.82 7.52 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.708 0.803 . . . . 0.0 110.727 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 131.52 157.75 8.88 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 124.358 0.98 . . . . 0.0 112.698 179.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 5.1 m -158.56 146.84 18.43 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.525 2.33 . . . . 0.0 106.139 178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -161.1 -153.49 7.02 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 109.791 -1.324 . . . . 0.0 109.791 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 -77.8 -137.07 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 106.056 -1.831 . . . . 0.0 106.056 178.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -66.51 159.71 26.66 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.577 -1.327 . . . . 0.0 110.205 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.3 mt -98.44 99.66 9.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 178.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.2 tt0 -74.73 -7.32 52.97 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 121.513 -0.742 . . . . 0.0 112.017 -179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 6.0 t -124.63 55.94 1.31 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 124.967 1.307 . . . . 0.0 108.72 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 12.7 t80 -164.64 -43.52 0.03 OUTLIER 'General case' 0 C--N 1.341 0.221 0 O-C-N 121.639 -0.663 . . . . 0.0 111.35 179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.34 12.35 1.96 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.93 -32.38 20.57 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 114.283 1.216 . . . . 0.0 114.283 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -77.68 -31.45 52.5 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.043 0.383 . . . . 0.0 111.776 179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -78.87 -26.69 43.97 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 178.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.502 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -57.4 -46.5 85.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.11 0 C-N-CA 126.859 2.064 . . . . 0.0 110.307 -179.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -63.04 -30.0 71.26 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 119.462 -0.304 . . . . 0.0 110.671 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.48 -48.67 16.52 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 125.069 1.348 . . . . 0.0 111.486 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 4.1 p -68.08 -38.77 80.32 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.103 0 CA-C-O 121.425 0.631 . . . . 0.0 109.625 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.401 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -68.83 -31.19 69.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 119.983 -1.698 . . . . 0.0 109.775 179.474 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.9 mtpt -57.51 -28.16 63.21 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.427 1.012 . . . . 0.0 110.374 178.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -71.88 -39.14 69.81 Favored 'General case' 0 C--O 1.223 -0.328 0 O-C-N 121.891 -0.506 . . . . 0.0 110.362 -179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.2 mt -81.17 -34.41 32.41 Favored 'General case' 0 C--O 1.224 -0.273 0 N-CA-C 117.895 2.554 . . . . 0.0 117.895 -179.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -60.86 -21.94 63.74 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 119.482 1.037 . . . . 0.0 113.37 -178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.5 p30 -96.93 -1.54 45.56 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.253 0.621 . . . . 0.0 111.201 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -85.41 159.27 20.02 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.31 1.044 . . . . 0.0 110.504 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 17.2 m -85.26 168.26 14.89 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.802 2.441 . . . . 0.0 111.71 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -62.09 -50.55 71.5 Favored 'General case' 0 C--O 1.208 -1.106 0 CA-C-N 120.233 1.379 . . . . 0.0 108.197 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -52.55 -27.07 15.09 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 119.267 0.94 . . . . 0.0 112.293 -178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -79.57 -51.92 8.66 Favored 'General case' 0 N--CA 1.449 -0.521 0 O-C-N 120.659 -1.275 . . . . 0.0 109.939 177.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.4 mt -76.99 -54.37 6.64 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 126.9 2.08 . . . . 0.0 115.078 -178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.12 -40.17 67.11 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 127.665 2.386 . . . . 0.0 106.685 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.15 -26.66 67.53 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -179.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.2 mmt -75.53 -55.32 5.79 Favored 'General case' 0 N--CA 1.464 0.267 0 O-C-N 121.041 -1.037 . . . . 0.0 110.27 -179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.606 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.9 pp -63.83 -39.97 95.48 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 123.709 0.804 . . . . 0.0 111.015 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -79.48 -20.58 46.98 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 122.613 0.365 . . . . 0.0 111.109 -179.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 65.74 30.23 76.83 Favored Glycine 0 CA--C 1.526 0.781 0 CA-C-O 118.985 -0.897 . . . . 0.0 111.377 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.2 135.04 54.12 Favored 'General case' 0 CA--C 1.51 -0.59 0 C-N-CA 126.049 1.74 . . . . 0.0 110.855 -178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -86.63 99.11 11.49 Favored 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.267 0.627 . . . . 0.0 110.845 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 C--O 1.25 1.109 0 C-N-CA 125.906 1.682 . . . . 0.0 107.746 177.069 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.8 mtm . . . . . 0 CA--C 1.508 -0.662 0 CA-C-O 119.113 -0.47 . . . . 0.0 110.589 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -58.94 147.44 34.16 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.1 tp -62.38 145.55 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 -179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -124.77 -36.08 2.63 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 126.155 1.782 . . . . 0.0 109.614 179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -58.54 -39.42 80.12 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 122.731 1.253 . . . . 0.0 108.147 179.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -77.45 -29.3 52.72 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.166 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -67.5 -35.48 79.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 118.058 -0.973 . . . . 0.0 109.316 178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 17.1 mt -53.08 -29.75 32.22 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 124.071 0.949 . . . . 0.0 108.959 -179.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -52.31 -46.44 65.97 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.34 1.456 . . . . 0.0 110.301 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.2 ptmt -68.61 -28.84 67.28 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.387 0.539 . . . . 0.0 111.093 179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.55 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.35 -53.8 8.13 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.845 0.858 . . . . 0.0 109.24 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -44.09 91.38 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 120.542 -1.349 . . . . 0.0 111.46 -178.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -60.98 -31.36 70.96 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 118.531 0.605 . . . . 0.0 110.428 178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.95 -44.49 65.98 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.445 -1.41 . . . . 0.0 108.498 178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.422 HG23 HD23 ' A' 3316 ' ' LEU . 86.6 t -66.3 -38.48 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 123.999 0.92 . . . . 0.0 110.092 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . 0.25 1.1 pp -66.19 -40.86 90.74 Favored 'General case' 0 C--O 1.226 -0.162 0 O-C-N 121.055 -1.028 . . . . 0.0 108.889 179.499 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -56.46 -49.81 73.52 Favored 'General case' 0 C--N 1.343 0.293 0 CA-C-N 119.169 0.895 . . . . 0.0 111.896 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.22 -36.69 79.89 Favored 'General case' 0 C--O 1.224 -0.239 0 CA-C-N 120.448 1.477 . . . . 0.0 110.977 178.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.409 ' HD2' HG12 ' A' ' 15' ' ' VAL . 15.2 mttp -55.21 -29.37 57.8 Favored 'General case' 0 N--CA 1.462 0.17 0 CA-C-N 119.208 0.913 . . . . 0.0 111.399 179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.435 HD12 HD11 ' A' 3297 ' ' ILE . 4.7 mm -60.59 -45.56 97.07 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-N 119.789 1.177 . . . . 0.0 108.396 178.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 46.0 mttt -70.64 -29.28 65.6 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 126.874 2.07 . . . . 0.0 110.611 179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -75.27 -49.63 18.64 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -177.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.42 HH21 ' CG ' ' A' 3296 ' ' ASP . 0.0 OUTLIER -64.26 -31.28 72.41 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 118.303 0.501 . . . . 0.0 112.193 -179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -78.22 -45.84 26.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 O-C-N 120.866 -1.146 . . . . 0.0 110.494 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -70.87 -48.13 55.47 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -177.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -76.5 -51.2 12.18 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -178.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 6.0 t 56.61 20.24 4.83 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.749 1.62 . . . . 0.0 112.661 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.408 ' C ' HD12 ' A' ' 28' ' ' LEU . 3.3 pp -134.76 177.13 8.03 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.904 1.681 . . . . 0.0 109.883 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 62.3 m -118.68 -48.07 2.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.558 1.143 . . . . 0.0 114.041 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.454 HG22 ' HE2' ' A' ' 32' ' ' LYS . 12.6 t -141.07 30.34 1.81 Allowed 'General case' 0 N--CA 1.47 0.53 0 CA-C-N 118.996 0.816 . . . . 0.0 110.966 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.256 14.5 mt-10 66.11 34.63 6.7 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 122.338 1.066 . . . . 0.0 110.844 179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HE2' HG22 ' A' ' 30' ' ' THR . 15.3 mtmt -72.42 163.3 28.22 Favored 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 178.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -128.32 -68.12 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 105.645 -1.983 . . . . 0.0 105.645 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 96.54 -118.61 6.06 Favored Glycine 0 CA--C 1.521 0.467 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 44.1 t -151.96 -99.81 0.06 Allowed 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -179.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 77.59 82.89 0.57 Allowed Glycine 0 CA--C 1.523 0.534 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -137.85 18.53 2.85 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.323 1.449 . . . . 0.0 111.558 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -102.26 -97.73 2.37 Favored Glycine 0 C--N 1.338 0.667 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.8 t 57.48 -1.16 0.07 Allowed 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 126.754 2.021 . . . . 0.0 115.946 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -102.79 43.33 1.7 Allowed Glycine 0 CA--C 1.524 0.622 0 CA-C-N 120.474 1.488 . . . . 0.0 111.06 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.2 m -156.84 172.12 19.2 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.697 1.199 . . . . 0.0 109.092 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -68.79 130.5 25.35 Favored Glycine 0 CA--C 1.524 0.622 0 N-CA-C 108.462 -1.855 . . . . 0.0 108.462 179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.2 p -59.55 152.0 23.07 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 117.226 0.513 . . . . 0.0 109.784 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -150.85 36.69 0.9 Allowed Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.263 1.411 . . . . 0.0 110.409 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.4 m -66.75 173.48 3.49 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.173 1.789 . . . . 0.0 111.409 -179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -153.49 150.57 22.29 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.1 m -89.08 -175.37 4.79 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.082 1.353 . . . . 0.0 112.269 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.69 -169.39 13.61 Favored Glycine 0 CA--C 1.531 1.077 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 177.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 8.6 t -167.0 134.87 2.56 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.839 1.319 . . . . 0.0 112.92 178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.98 16.84 27.67 Favored Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.167 1.365 . . . . 0.0 110.522 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.0 p 51.84 24.29 2.45 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 128.068 2.547 . . . . 0.0 114.911 -179.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -121.13 172.93 15.38 Favored Glycine 0 CA--C 1.526 0.719 0 C-N-CA 125.723 1.63 . . . . 0.0 110.441 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.1 t -153.97 101.38 2.42 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 179.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.1 177.42 32.34 Favored Glycine 0 CA--C 1.521 0.441 0 O-C-N 121.721 -0.612 . . . . 0.0 111.934 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 44.1 m -144.82 174.17 11.22 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.752 1.621 . . . . 0.0 108.736 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -144.45 160.14 27.85 Favored Glycine 0 CA--C 1.526 0.736 0 N-CA-C 107.433 -2.267 . . . . 0.0 107.433 178.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 59.1 m -139.86 177.69 7.78 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.384 1.074 . . . . 0.0 109.864 -179.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 121.49 -136.47 11.13 Favored Glycine 0 CA--C 1.521 0.409 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.6 t80 -84.32 5.07 28.28 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 118.256 1.028 . . . . 0.0 111.807 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 20.6 pt20 -81.54 149.48 28.65 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 46.1 mt -74.55 101.79 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -64.03 -7.49 8.75 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -178.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.2 t -139.18 59.22 1.62 Allowed 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 124.156 0.982 . . . . 0.0 110.93 -179.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 25.4 t80 -153.58 -56.32 0.12 Allowed 'General case' 0 N--CA 1.462 0.17 0 O-C-N 120.849 -1.157 . . . . 0.0 111.455 179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -124.61 17.6 8.81 Favored 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.132 1.373 . . . . 0.0 110.512 -179.374 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.97 -34.11 27.51 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 120.031 1.287 . . . . 0.0 112.06 -179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 5.4 mm-40 -70.06 -36.93 75.34 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.933 1.293 . . . . 0.0 110.87 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . 0.42 ' CG ' HH21 ' A' ' 23' ' ' ARG . 0.1 OUTLIER -79.36 -29.96 42.42 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 125.264 1.426 . . . . 0.0 111.121 179.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.435 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -62.21 -45.8 97.93 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 C-N-CA 126.151 1.78 . . . . 0.0 109.567 -179.811 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.65 -35.13 78.3 Favored 'General case' 0 C--O 1.221 -0.407 0 O-C-N 123.61 0.569 . . . . 0.0 109.625 -178.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 47.8 t -67.04 -44.86 79.12 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 121.718 -0.614 . . . . 0.0 112.307 -177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.7 p -73.77 -42.73 54.23 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 120.223 -0.591 . . . . 0.0 109.496 -179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -31.15 72.24 Favored 'General case' 0 C--N 1.339 0.139 0 O-C-N 121.051 -1.031 . . . . 0.0 111.211 -179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.1 mtpp -60.7 -27.3 67.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.671 1.188 . . . . 0.0 110.705 177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.15 -45.22 27.47 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 88.7 mt -65.39 -34.78 79.11 Favored 'General case' 0 N--CA 1.439 -1.013 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -176.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.35 -14.3 26.21 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 112.865 0.691 . . . . 0.0 112.865 179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.3 p30 -112.0 2.84 17.07 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 123.881 0.872 . . . . 0.0 112.486 179.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -92.04 155.41 18.11 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 178.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 7.4 m -86.51 170.77 11.62 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.908 2.083 . . . . 0.0 110.293 179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -57.83 -46.46 84.71 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -52.23 -31.84 33.97 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.797 0.839 . . . . 0.0 111.593 -178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.8 mm-40 -81.56 -52.71 6.93 Favored 'General case' 0 N--CA 1.439 -0.982 0 O-C-N 120.85 -1.156 . . . . 0.0 112.297 179.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.3 mt -77.42 -53.84 7.16 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 126.446 1.899 . . . . 0.0 114.785 -178.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.433 HD22 HD11 ' A' 3316 ' ' LEU . 2.1 tm? -54.9 -36.75 65.53 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 106.437 -1.69 . . . . 0.0 106.437 178.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.23 -27.53 65.55 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.234 -179.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.89 -55.55 7.32 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.834 1.254 . . . . 0.0 112.223 -178.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.55 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.64 -30.91 71.29 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 124.127 0.971 . . . . 0.0 110.32 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -79.93 -26.2 40.21 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 64.18 40.16 97.77 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.388 1.471 . . . . 0.0 110.487 -179.599 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -127.34 176.75 7.19 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 124.841 1.256 . . . . 0.0 111.35 -178.149 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -90.29 14.77 11.86 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 126.336 1.855 . . . . 0.0 113.691 -179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.091 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.992 -179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 mmt . . . . . 0 N--CA 1.469 0.479 0 CA-C-O 120.782 0.325 . . . . 0.0 110.285 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -62.43 129.85 42.55 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.082 1.353 . . . . 0.0 113.165 -177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.6 tt -65.42 140.73 19.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.274 -1.751 . . . . 0.0 106.274 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -121.1 -40.93 2.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 113.28 -1.782 . . . . 0.0 110.022 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -58.39 -39.58 80.05 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 122.368 1.08 . . . . 0.0 110.434 -178.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -76.84 -27.34 55.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.764 0.826 . . . . 0.0 110.324 179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 91.3 m -77.03 -31.99 56.71 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 117.404 -1.284 . . . . 0.0 111.164 179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.94 -29.0 26.13 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -51.63 -48.7 63.22 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 126.353 1.861 . . . . 0.0 110.587 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.4 ptmt -67.28 -28.63 68.18 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 119.182 0.901 . . . . 0.0 110.579 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.446 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.36 -54.34 7.22 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 124.378 1.071 . . . . 0.0 108.783 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -41.93 88.45 Favored 'General case' 0 CA--C 1.507 -0.711 0 O-C-N 119.867 -1.771 . . . . 0.0 111.777 -179.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -65.06 -31.66 72.99 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.534 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.13 -36.6 74.89 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 121.079 -1.013 . . . . 0.0 108.951 178.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 81.6 t -72.02 -53.76 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 C-N-CA 123.315 0.646 . . . . 0.0 109.302 179.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -52.91 -32.45 45.42 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 119.903 1.229 . . . . 0.0 112.136 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -54.99 -38.99 68.53 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.885 178.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.71 -36.08 65.2 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 120.491 1.496 . . . . 0.0 109.389 178.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.2 mttm -54.85 -36.14 64.73 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.166 0.894 . . . . 0.0 110.013 179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.434 ' O ' HG22 ' A' ' 24' ' ' ILE . 7.0 mm -59.56 -38.39 75.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 CA-C-N 119.059 0.845 . . . . 0.0 110.314 179.39 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 42.6 mttm -74.35 -29.23 61.49 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 124.423 1.089 . . . . 0.0 110.18 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -74.35 -49.26 23.51 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -42.01 96.32 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 119.765 1.166 . . . . 0.0 111.232 179.23 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.434 HG22 ' O ' ' A' ' 20' ' ' ILE . 8.9 tt -68.37 -44.57 83.43 Favored 'Isoleucine or valine' 0 C--O 1.235 0.305 0 CA-C-N 119.097 0.862 . . . . 0.0 111.512 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -75.9 -48.44 21.32 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.745 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -75.21 -50.88 14.79 Favored 'General case' 0 CA--C 1.515 -0.398 0 C-N-CA 123.381 0.672 . . . . 0.0 110.277 -177.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.4 t 52.8 20.5 1.62 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.064 1.346 . . . . 0.0 113.03 -179.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.8 pp -124.92 175.15 7.5 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 125.918 1.687 . . . . 0.0 110.377 -178.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 65.9 m -112.86 -45.15 3.22 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 113.321 -1.763 . . . . 0.0 111.564 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -162.94 43.11 0.12 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 -178.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 63.15 28.69 16.04 Favored 'General case' 0 N--CA 1.47 0.563 0 O-C-N 120.875 -1.141 . . . . 0.0 109.066 -178.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.73 106.84 5.65 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 103.844 -2.65 . . . . 0.0 103.844 179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.4 172.56 6.96 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 123.003 0.521 . . . . 0.0 111.747 -178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 160.75 153.63 7.05 Favored Glycine 0 CA--C 1.525 0.684 0 C-N-CA 124.751 1.167 . . . . 0.0 110.332 179.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 53.6 m -142.46 173.21 11.74 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.262 1.425 . . . . 0.0 109.239 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -178.24 178.6 48.6 Favored Glycine 0 CA--C 1.526 0.722 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 57.7 p -139.4 169.13 18.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.606 1.162 . . . . 0.0 111.204 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -149.05 146.58 16.13 Favored Glycine 0 CA--C 1.522 0.472 0 N-CA-C 109.101 -1.599 . . . . 0.0 109.101 179.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 50.8 m -128.36 174.97 8.86 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.483 1.513 . . . . 0.0 109.119 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -158.68 179.67 34.17 Favored Glycine 0 CA--C 1.521 0.452 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.8 m -155.98 154.79 31.66 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.559 -0.965 . . . . 0.0 109.461 179.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -73.24 169.76 52.81 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.531 -1.028 . . . . 0.0 110.531 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 m -156.63 161.44 39.91 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 179.572 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.62 101.09 0.16 Allowed Glycine 0 C--O 1.226 -0.345 0 N-CA-C 108.371 -1.892 . . . . 0.0 108.371 -179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 9.3 t -165.98 -177.27 4.14 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.151 1.78 . . . . 0.0 106.772 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.65 -170.62 54.87 Favored Glycine 0 CA--C 1.527 0.802 0 N-CA-C 110.328 -1.109 . . . . 0.0 110.328 -179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.5 m -149.72 -12.45 0.28 Allowed 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -166.36 38.69 0.26 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 119.514 1.052 . . . . 0.0 111.541 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 6.2 m -58.44 -20.18 42.82 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.951 1.701 . . . . 0.0 115.351 -178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.78 179.63 51.69 Favored Glycine 0 CA--C 1.528 0.858 0 CA-C-N 119.517 1.053 . . . . 0.0 110.539 -179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.2 p -142.57 174.85 10.27 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.279 1.831 . . . . 0.0 109.187 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -146.73 167.48 28.17 Favored Glycine 0 CA--C 1.524 0.635 0 N-CA-C 110.296 -1.122 . . . . 0.0 110.296 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.2 m -121.58 -13.64 8.33 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 115.377 1.621 . . . . 0.0 115.377 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 79.17 -173.42 55.3 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 109.067 -1.613 . . . . 0.0 109.067 -178.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.9 m -136.14 -160.47 1.06 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.588 1.155 . . . . 0.0 110.491 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.75 88.63 1.94 Allowed Glycine 0 C--N 1.34 0.753 0 N-CA-C 107.48 -2.248 . . . . 0.0 107.48 -179.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.3 t -131.66 -27.0 1.96 Allowed 'General case' 0 C--O 1.237 0.418 0 N-CA-C 113.79 1.034 . . . . 0.0 113.79 -178.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -169.07 -71.34 0.03 OUTLIER Glycine 0 C--N 1.335 0.481 0 N-CA-C 110.337 -1.105 . . . . 0.0 110.337 -179.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -68.15 -178.69 1.09 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 118.017 0.909 . . . . 0.0 110.574 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -54.74 161.05 1.66 Allowed 'General case' 0 C--O 1.234 0.263 0 C-N-CA 123.548 0.739 . . . . 0.0 112.146 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 25.9 mt -109.13 90.56 1.51 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 122.212 1.006 . . . . 0.0 108.625 -178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -65.23 -7.14 11.65 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.564 1.946 . . . . 0.0 111.079 178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.7 t -118.97 36.45 4.45 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 127.111 2.164 . . . . 0.0 111.522 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.1 t80 -153.15 -59.81 0.14 Allowed 'General case' 0 C--N 1.343 0.318 0 O-C-N 121.394 -0.817 . . . . 0.0 112.049 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -116.45 11.35 14.87 Favored 'General case' 0 N--CA 1.466 0.344 0 C-N-CA 124.299 1.039 . . . . 0.0 112.242 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.86 -31.58 40.12 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 119.386 0.994 . . . . 0.0 112.738 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 76.8 mm-40 -64.7 -38.07 89.75 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.487 1.115 . . . . 0.0 109.948 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.82 -28.73 36.1 Favored 'General case' 0 N--CA 1.462 0.174 0 O-C-N 121.612 -0.68 . . . . 0.0 111.454 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -53.41 -48.03 57.65 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.414 0 C-N-CA 126.286 1.834 . . . . 0.0 110.275 -177.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -64.68 -43.96 91.86 Favored 'General case' 0 N--CA 1.442 -0.837 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 33.1 t -61.68 -44.31 97.19 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 123.052 0.541 . . . . 0.0 111.145 -178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -76.13 -39.37 35.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 O-C-N 121.408 -0.808 . . . . 0.0 110.595 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.2 -30.71 66.73 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 120.565 -1.335 . . . . 0.0 111.543 -179.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.9 mtpp -58.11 -27.81 64.06 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 126.042 1.737 . . . . 0.0 110.971 178.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -76.49 -43.43 39.62 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 14.0 mt -77.67 -33.44 53.34 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 116.694 2.109 . . . . 0.0 116.694 -178.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -59.68 -12.84 7.73 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.615 0.968 . . . . 0.0 113.615 -179.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 3.6 p30 -114.18 0.07 14.11 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.712 0.805 . . . . 0.0 112.309 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.88 154.8 23.24 Favored 'General case' 0 C--N 1.342 0.28 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 71.4 m -75.76 166.28 23.77 Favored 'General case' 0 C--N 1.331 -0.218 0 C-N-CA 123.545 0.738 . . . . 0.0 111.18 179.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.9 mt-10 -59.71 -43.85 93.94 Favored 'General case' 0 C--O 1.2 -1.533 0 N-CA-C 106.317 -1.734 . . . . 0.0 106.317 177.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -52.4 -30.48 29.38 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 126.167 1.787 . . . . 0.0 111.935 -177.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -81.95 -52.61 6.89 Favored 'General case' 0 N--CA 1.434 -1.263 0 C-N-CA 124.655 1.182 . . . . 0.0 110.714 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.06 -53.13 9.42 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.413 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.1 tm? -54.55 -40.99 69.23 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 128.278 2.631 . . . . 0.0 105.448 178.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.24 -26.2 65.57 Favored 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 119.456 -0.898 . . . . 0.0 111.9 -179.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mtt -74.35 -55.33 6.12 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 119.692 -1.88 . . . . 0.0 110.387 -179.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.534 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.8 pp -64.23 -34.38 77.96 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.986 0.914 . . . . 0.0 111.079 -179.643 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -83.27 -26.26 30.85 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 118.003 0.365 . . . . 0.0 111.112 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 114.07 -45.19 1.35 Allowed Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.857 1.217 . . . . 0.0 111.163 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 2.2 p30 -158.16 167.65 29.23 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 119.276 1.538 . . . . 0.0 112.817 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -163.96 87.26 0.5 Allowed 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 126.736 2.014 . . . . 0.0 108.107 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . 0.579 ' H ' HE21 ' A' 3321 ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.245 0.85 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 178.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.1 mtp . . . . . 0 N--CA 1.472 0.657 0 CA-C-O 118.011 -0.995 . . . . 0.0 113.512 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -60.35 100.63 0.1 Allowed 'General case' 0 C--O 1.236 0.37 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 11.0 tt -164.35 137.68 1.07 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.227 0 C-N-CA 125.674 1.59 . . . . 0.0 109.589 179.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -106.75 -44.02 4.55 Favored 'General case' 0 C--O 1.223 -0.329 0 C-N-CA 126.453 1.901 . . . . 0.0 110.647 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -57.9 -43.6 86.24 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.015 1.326 . . . . 0.0 111.293 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -71.48 -27.62 63.37 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.17 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 49.6 m -72.07 -36.11 69.47 Favored 'General case' 0 C--O 1.224 -0.237 0 CA-C-O 118.324 -0.846 . . . . 0.0 111.145 178.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.4 mt -53.33 -29.21 32.72 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 124.656 1.182 . . . . 0.0 108.597 -178.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -52.62 -44.23 65.92 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.581 1.152 . . . . 0.0 111.487 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.1 ptmt -70.37 -28.59 65.22 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 118.688 0.677 . . . . 0.0 110.425 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.624 HD12 HD21 ' A' 3316 ' ' LEU . 3.4 mm? -75.36 -52.21 11.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.189 0.995 . . . . 0.0 108.727 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -42.91 87.39 Favored 'General case' 0 CA--C 1.503 -0.846 0 O-C-N 119.82 -1.8 . . . . 0.0 111.389 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.409 ' HA ' ' CD2' ' A' ' 16' ' ' LEU . 4.9 pp0? -61.82 -31.43 71.66 Favored 'General case' 0 CA--C 1.544 0.735 0 CA-C-N 118.291 0.496 . . . . 0.0 110.767 178.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.574 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.04 -39.97 75.42 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.229 -1.545 . . . . 0.0 108.474 178.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 26.1 t -70.75 -34.98 58.63 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 O-C-N 121.59 -0.694 . . . . 0.0 109.408 178.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.409 ' CD2' ' HA ' ' A' ' 13' ' ' GLN . 1.6 pp -69.48 -36.95 77.02 Favored 'General case' 0 CA--C 1.533 0.327 0 O-C-N 120.297 -1.502 . . . . 0.0 107.782 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -57.5 -50.04 74.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 119.929 1.24 . . . . 0.0 112.866 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.9 ptmm? -62.89 -40.91 98.98 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 120.124 1.329 . . . . 0.0 109.6 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 mttm -55.26 -33.93 63.59 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.012 179.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.422 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.6 mm -61.35 -44.96 99.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 120.119 1.327 . . . . 0.0 108.943 179.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 33.2 mtmt -67.86 -29.45 68.58 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 123.154 0.582 . . . . 0.0 110.203 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -71.51 -50.03 35.36 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.438 -0.789 . . . . 0.0 109.209 -178.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.57 -34.82 79.14 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 118.269 -0.872 . . . . 0.0 112.869 -179.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.422 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.5 tt -77.82 -44.51 28.65 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.43 1.014 . . . . 0.0 110.496 179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -72.44 -48.14 43.46 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.447 ' C ' ' H ' ' A' ' 28' ' ' LEU . 3.8 m-80 -77.0 -52.43 9.38 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-O 121.888 0.852 . . . . 0.0 110.099 -178.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . 0.285 1.8 t 70.35 -33.2 0.26 Allowed 'General case' 0 C--N 1.338 0.074 0 C-N-CA 128.585 2.754 . . . . 0.0 113.48 -178.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -73.75 180.0 3.92 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 128.383 2.673 . . . . 0.0 111.505 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 26.0 m -132.14 -26.86 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 114.563 1.32 . . . . 0.0 114.563 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -165.29 29.71 0.06 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.043 0.937 . . . . 0.0 108.509 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 58.84 27.18 15.76 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.44 1.096 . . . . 0.0 112.436 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.11 38.78 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 128.225 2.61 . . . . 0.0 115.558 -178.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.6 m-30 -64.61 -74.54 0.1 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 120.395 1.452 . . . . 0.0 110.591 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.09 -44.44 2.62 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.995 1.284 . . . . 0.0 114.5 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 78.7 p -145.82 -176.88 5.31 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.811 1.306 . . . . 0.0 111.009 -179.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -172.14 171.93 44.49 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.911 1.72 . . . . 0.0 109.379 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 74.6 p -156.51 177.14 11.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.762 1.625 . . . . 0.0 110.162 -179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -110.95 -172.93 19.79 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.364 0.983 . . . . 0.0 113.551 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.4 t -81.68 -115.37 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 127.84 2.456 . . . . 0.0 109.359 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -168.24 166.15 39.3 Favored Glycine 0 CA--C 1.53 1.013 0 C-N-CA 127.127 2.299 . . . . 0.0 108.196 179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.1 t -71.75 -30.48 65.63 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 66.61 -171.43 29.9 Favored Glycine 0 CA--C 1.535 1.3 0 N-CA-C 110.743 -0.943 . . . . 0.0 110.743 -178.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 11.5 t -168.65 170.98 9.08 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 126.503 1.921 . . . . 0.0 106.693 179.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 162.99 171.25 28.99 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.5 p -162.91 174.71 12.02 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.578 1.151 . . . . 0.0 108.79 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 142.77 166.03 10.87 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 t -77.74 0.39 23.78 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.856 0.687 . . . . 0.0 112.856 -179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 131.26 82.49 0.25 Allowed Glycine 0 C--N 1.337 0.593 0 N-CA-C 108.587 -1.805 . . . . 0.0 108.587 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.9 t -69.11 -2.68 10.83 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.608 0.966 . . . . 0.0 113.608 -179.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.47 -178.53 10.77 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.625 1.107 . . . . 0.0 111.454 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 11.8 p -152.15 173.98 14.28 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 124.059 0.944 . . . . 0.0 108.491 179.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.77 155.89 16.41 Favored Glycine 0 N--CA 1.447 -0.576 0 N-CA-C 107.001 -2.44 . . . . 0.0 107.001 179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.3 m -164.57 169.29 17.24 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 124.09 0.956 . . . . 0.0 109.124 179.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.46 132.74 2.65 Favored Glycine 0 CA--C 1.52 0.403 0 N-CA-C 108.204 -1.959 . . . . 0.0 108.204 -179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 67.0 m -164.23 150.19 10.85 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.301 1.84 . . . . 0.0 108.081 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 161.66 165.16 18.0 Favored Glycine 0 CA--C 1.526 0.74 0 C-N-CA 123.879 0.752 . . . . 0.0 111.313 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 t -148.29 -96.88 0.08 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 160.35 -65.67 0.27 Allowed Glycine 0 C--N 1.334 0.44 0 N-CA-C 108.151 -1.98 . . . . 0.0 108.151 -179.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -71.1 -178.73 2.08 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 117.527 0.664 . . . . 0.0 110.636 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -57.62 162.32 3.09 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.337 0.589 . . . . 0.0 110.18 179.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 23.5 mt -92.96 98.28 8.18 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.584 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -70.89 -9.3 57.44 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 122.087 -0.383 . . . . 0.0 110.896 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.3 t -122.2 54.79 1.16 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.447 1.899 . . . . 0.0 111.941 -178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.8 t80 -162.59 -47.89 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.18 0 O-C-N 120.624 -1.298 . . . . 0.0 111.543 178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.72 13.71 3.69 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.57 -30.85 33.0 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 120.627 1.558 . . . . 0.0 112.998 -179.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 90.3 mm-40 -71.78 -39.44 69.91 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 124.383 1.073 . . . . 0.0 110.428 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 85.3 m-20 -79.33 -26.55 42.14 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 121.399 -0.813 . . . . 0.0 111.183 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -63.83 -46.48 94.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 C-N-CA 125.385 1.474 . . . . 0.0 109.07 -178.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -68.88 -29.15 67.39 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 116.497 -0.32 . . . . 0.0 110.479 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 16.3 t -71.91 -46.8 56.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.314 1.846 . . . . 0.0 110.974 -179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.5 p -74.74 -41.86 47.49 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.405 ' CB ' HD22 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.52 -30.03 70.99 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.135 -1.603 . . . . 0.0 110.36 179.018 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 23.9 mtpt -55.93 -27.68 53.44 Favored 'General case' 0 C--N 1.339 0.117 0 C-N-CA 123.875 0.87 . . . . 0.0 110.795 177.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -75.1 -36.43 61.69 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.514 -0.741 . . . . 0.0 109.232 178.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 87.9 mt -78.83 -35.56 43.84 Favored 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 126.805 2.042 . . . . 0.0 116.445 -179.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -56.73 -16.62 6.77 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.939 1.295 . . . . 0.0 113.651 -178.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -109.24 -5.38 15.93 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 118.882 0.765 . . . . 0.0 112.238 179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.02 158.62 31.68 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 119.247 0.931 . . . . 0.0 110.146 179.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 16.3 m -83.64 168.97 15.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 125.266 1.426 . . . . 0.0 109.382 178.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -58.52 -50.53 73.43 Favored 'General case' 0 C--O 1.204 -1.337 0 CA-C-O 117.194 -1.384 . . . . 0.0 107.54 179.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -51.34 -28.31 12.01 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 120.431 1.469 . . . . 0.0 112.869 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -79.85 -51.94 8.51 Favored 'General case' 0 N--CA 1.437 -1.09 0 O-C-N 119.59 -1.944 . . . . 0.0 109.577 179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.33 -53.9 7.53 Favored 'General case' 0 CA--C 1.521 -0.149 0 C-N-CA 125.292 1.437 . . . . 0.0 114.703 -177.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.29 -41.66 69.16 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 128.991 2.916 . . . . 0.0 107.027 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.21 -26.36 65.68 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.131 -0.628 . . . . 0.0 111.958 -179.195 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -78.29 -56.14 4.69 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 119.585 1.084 . . . . 0.0 109.67 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.624 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -59.73 -36.34 76.39 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 123.215 0.606 . . . . 0.0 110.857 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.46 -26.02 30.66 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 117.967 0.349 . . . . 0.0 111.103 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 72.4 53.47 8.75 Favored Glycine 0 C--N 1.335 0.48 0 C-N-CA 125.778 1.656 . . . . 0.0 109.804 -179.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.59 -149.5 0.3 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.491 1.116 . . . . 0.0 111.595 -179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -141.43 27.01 1.92 Allowed 'General case' 0 C--O 1.237 0.406 0 C-N-CA 126.784 2.033 . . . . 0.0 111.999 179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 66.9 mm-40 . . . . . 0 C--O 1.249 1.042 0 CA-C-O 115.715 -2.088 . . . . 0.0 108.709 178.793 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.3 mtt . . . . . 0 N--CA 1.472 0.667 0 CA-C-O 118.09 -0.957 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -76.62 119.92 21.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 13.0 tt -52.52 132.51 14.56 Favored 'Isoleucine or valine' 0 C--O 1.232 0.138 0 C-N-CA 124.501 1.12 . . . . 0.0 110.464 -179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -103.13 -34.31 8.9 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 124.43 1.092 . . . . 0.0 109.651 179.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -58.44 -40.3 82.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 122.1 0.952 . . . . 0.0 109.964 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.76 -31.25 67.99 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 123.923 0.889 . . . . 0.0 109.665 178.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -72.69 -34.36 67.12 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 118.099 -0.953 . . . . 0.0 111.718 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.8 mt -53.24 -30.87 40.56 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 119.855 1.207 . . . . 0.0 108.461 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -52.33 -47.12 66.21 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 125.204 1.401 . . . . 0.0 111.128 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.88 -29.04 68.05 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.934 -0.706 . . . . 0.0 110.522 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.628 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -74.98 -53.22 9.33 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.486 1.115 . . . . 0.0 109.469 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.415 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 14.3 ptt85 -59.64 -44.15 93.62 Favored 'General case' 0 CA--C 1.505 -0.755 0 O-C-N 120.216 -1.552 . . . . 0.0 111.504 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -63.09 -31.4 72.54 Favored 'General case' 0 N--CA 1.445 -0.707 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.19 -38.55 69.05 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 120.967 -1.083 . . . . 0.0 109.431 178.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.516 HG23 HD23 ' A' 3316 ' ' LEU . 99.3 t -70.16 -53.19 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 O-C-N 121.081 -1.012 . . . . 0.0 108.905 179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.408 ' HB3' HD12 ' A' 3304 ' ' LEU . 3.4 pp -55.06 -32.71 62.14 Favored 'General case' 0 CA--C 1.52 -0.199 0 CA-C-O 118.082 -0.961 . . . . 0.0 110.692 179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -55.95 -48.79 75.11 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 117.585 -1.197 . . . . 0.0 109.733 178.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.87 -38.21 90.26 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.687 1.585 . . . . 0.0 110.702 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.9 mttm -54.79 -37.65 66.33 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.341 0.973 . . . . 0.0 110.117 -179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.434 HD12 ' CD1' ' A' 3297 ' ' ILE . 3.4 mm -62.72 -38.44 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.564 -0.71 . . . . 0.0 110.332 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.2 mttm -73.94 -28.75 61.66 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 125.288 1.435 . . . . 0.0 109.547 178.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.8 mt-10 -74.6 -49.47 21.53 Favored 'General case' 0 N--CA 1.454 -0.272 0 O-C-N 121.192 -0.942 . . . . 0.0 110.058 -179.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -37.99 69.49 Favored 'General case' 0 N--CA 1.478 0.963 0 CA-C-N 119.646 1.112 . . . . 0.0 111.774 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.5 tt -74.92 -49.7 27.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 C-N-CA 122.49 0.316 . . . . 0.0 110.738 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 50.9 tt0 -68.07 -47.35 68.53 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 114.793 1.405 . . . . 0.0 114.793 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -77.53 -52.11 9.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 124.008 0.923 . . . . 0.0 109.655 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 56.21 2.0 0.08 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 127.736 2.414 . . . . 0.0 116.074 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.61 -170.84 1.92 Allowed 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 127.446 2.298 . . . . 0.0 111.474 -179.44 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 59.7 m -131.9 -51.34 0.97 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 127.919 2.488 . . . . 0.0 107.504 178.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -150.91 37.83 0.65 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.965 1.306 . . . . 0.0 108.608 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 66.2 13.0 8.93 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.797 1.639 . . . . 0.0 113.733 179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.96 -74.74 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 126.879 2.072 . . . . 0.0 115.39 -178.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -164.02 173.61 12.36 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.788 0.722 . . . . 0.0 109.392 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.23 -177.72 16.07 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 127.325 2.393 . . . . 0.0 108.788 178.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.7 t -165.22 160.91 18.97 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 119.111 1.456 . . . . 0.0 109.058 179.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -157.41 179.87 32.84 Favored Glycine 0 CA--C 1.528 0.897 0 C-N-CA 126.503 2.001 . . . . 0.0 109.657 179.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -165.29 169.13 16.23 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.758 1.223 . . . . 0.0 108.408 179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -135.15 164.58 24.79 Favored Glycine 0 CA--C 1.525 0.695 0 N-CA-C 108.971 -1.652 . . . . 0.0 108.971 179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 76.1 p -105.16 -130.5 0.28 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 118.736 1.268 . . . . 0.0 111.439 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 162.49 -107.92 0.33 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 107.854 -2.098 . . . . 0.0 107.854 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.7 p 56.0 7.69 0.31 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 126.248 1.819 . . . . 0.0 115.901 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -63.57 140.35 44.46 Favored Glycine 0 CA--C 1.528 0.888 0 N-CA-C 109.468 -1.453 . . . . 0.0 109.468 179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.8 t -158.14 179.83 8.8 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.529 1.132 . . . . 0.0 108.262 179.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -174.02 162.88 33.62 Favored Glycine 0 CA--C 1.524 0.647 0 N-CA-C 108.903 -1.679 . . . . 0.0 108.903 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 75.6 m -158.18 79.57 0.83 Allowed 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.93 -36.94 0.9 Allowed Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.864 1.221 . . . . 0.0 113.704 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.5 t -73.36 178.32 4.64 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.372 1.469 . . . . 0.0 110.12 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -79.36 -148.45 4.57 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 125.235 1.398 . . . . 0.0 110.516 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 t -138.3 176.89 8.3 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.675 0.79 . . . . 0.0 109.628 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.47 171.76 42.75 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 109.183 -1.567 . . . . 0.0 109.183 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 26.9 t -159.87 -179.59 7.96 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 126.105 1.762 . . . . 0.0 106.269 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 179.09 152.07 10.23 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 109.044 -1.623 . . . . 0.0 109.044 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.9 t -150.82 -174.23 4.72 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.807 1.243 . . . . 0.0 108.843 -179.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 160.82 178.08 34.49 Favored Glycine 0 CA--C 1.524 0.601 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 16.9 t -162.66 -174.68 4.07 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.327 1.451 . . . . 0.0 107.8 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -157.73 174.44 35.11 Favored Glycine 0 CA--C 1.526 0.754 0 C-N-CA 126.747 2.118 . . . . 0.0 108.501 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.3 p -165.8 173.51 10.57 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.388 1.475 . . . . 0.0 108.644 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 142.34 -137.31 7.76 Favored Glycine 0 C--O 1.239 0.43 0 N-CA-C 109.335 -1.506 . . . . 0.0 109.335 179.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -63.19 -177.9 0.21 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.599 1.559 . . . . 0.0 110.915 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -56.88 153.68 10.59 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 124.076 0.95 . . . . 0.0 110.828 179.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.7 mt -93.74 91.4 3.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.475 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 -178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.19 -7.53 18.72 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.623 1.169 . . . . 0.0 111.804 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 10.8 t -123.01 51.92 1.4 Allowed 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.991 1.716 . . . . 0.0 110.166 -179.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.6 t80 -162.57 -53.48 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.974 0.91 . . . . 0.0 112.021 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.14 12.79 7.74 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -178.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -53.51 -31.13 44.73 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 119.674 1.124 . . . . 0.0 112.523 -179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 84.8 mm-40 -65.54 -40.73 93.24 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 122.903 0.481 . . . . 0.0 109.773 179.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -80.36 -34.25 36.62 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.915 0.78 . . . . 0.0 112.159 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.434 ' CD1' HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -54.72 -45.87 73.55 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 C-N-CA 125.638 1.575 . . . . 0.0 109.852 -179.309 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.35 -32.05 71.93 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 123.328 0.393 . . . . 0.0 110.227 -178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 4.2 t -73.64 -31.74 63.66 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 121.793 -0.567 . . . . 0.0 110.541 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 37.5 t -74.78 -45.64 43.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 107.527 -1.286 . . . . 0.0 107.527 179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.453 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -63.93 -36.02 82.57 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.294 -0.86 . . . . 0.0 109.703 -179.603 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 49.2 mtpt -65.74 -28.5 69.09 Favored 'General case' 0 C--N 1.337 0.046 0 C-N-CA 124.733 1.213 . . . . 0.0 110.383 178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.93 -47.96 33.97 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.502 -1.296 . . . . 0.0 107.502 179.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . 0.408 HD12 ' HB3' ' A' ' 16' ' ' LEU . 11.6 mt -71.28 -29.56 65.2 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 117.709 2.485 . . . . 0.0 117.709 -177.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . 0.415 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 25.6 pt-20 -63.24 -16.93 61.78 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.063 1.134 . . . . 0.0 114.063 -179.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 12.0 p30 -102.37 -1.73 30.31 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 177.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -85.86 155.87 20.78 Favored 'General case' 0 C--N 1.346 0.429 0 CA-C-N 118.822 0.737 . . . . 0.0 110.911 179.069 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 35.1 m -86.22 165.07 16.79 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 127.262 2.225 . . . . 0.0 110.849 179.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.1 mt-10 -56.77 -49.45 75.24 Favored 'General case' 0 C--O 1.209 -1.03 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -51.44 -29.37 15.87 Favored 'General case' 0 C--N 1.317 -0.832 0 C-N-CA 126.107 1.763 . . . . 0.0 112.479 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -80.84 -52.08 7.89 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.608 0.763 . . . . 0.0 111.006 178.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.2 mt -75.89 -53.39 8.51 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 126.231 1.812 . . . . 0.0 113.9 -177.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.24 -41.45 68.75 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 127.806 2.442 . . . . 0.0 106.694 178.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.33 -27.52 69.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.619 -0.833 . . . . 0.0 112.29 -179.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -78.57 -55.68 5.02 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.067 -1.021 . . . . 0.0 111.006 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.628 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.52 -35.65 78.31 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 118.266 -0.874 . . . . 0.0 111.534 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -85.62 -26.1 26.25 Favored 'General case' 0 C--N 1.335 -0.063 0 CA-C-N 118.396 0.544 . . . . 0.0 110.864 179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.76 64.33 2.74 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 107.831 -2.108 . . . . 0.0 107.831 -179.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -136.52 -157.85 0.82 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.08 0.952 . . . . 0.0 110.827 -179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.2 pp0? -143.54 35.18 1.3 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.725 2.01 . . . . 0.0 112.463 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 C--O 1.248 0.974 0 CA-C-O 116.158 -1.877 . . . . 0.0 112.318 -179.031 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.4 mtt . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 116.964 -1.493 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -65.51 92.95 0.14 Allowed 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 119.706 1.139 . . . . 0.0 110.343 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.4 tt -154.04 149.22 12.97 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 124.925 1.29 . . . . 0.0 107.913 179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -118.02 -53.58 2.36 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.493 0.717 . . . . 0.0 110.959 -179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -58.09 -39.39 78.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 123.929 0.891 . . . . 0.0 113.038 -178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -74.71 -28.21 60.71 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.945 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 64.2 m -72.7 -33.85 66.75 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 118.507 -0.758 . . . . 0.0 110.937 179.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.97 -29.03 26.6 Favored 'General case' 0 C--O 1.216 -0.665 0 C-N-CA 125.267 1.427 . . . . 0.0 107.975 -179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.64 -44.33 62.94 Favored 'General case' 0 C--O 1.231 0.093 0 C-N-CA 124.975 1.31 . . . . 0.0 110.237 179.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -69.39 -29.02 66.69 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.214 0.916 . . . . 0.0 110.548 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.06 -55.0 6.01 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.827 1.251 . . . . 0.0 110.976 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.67 -43.85 90.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 O-C-N 120.362 -1.461 . . . . 0.0 111.546 -178.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -61.1 -30.76 70.55 Favored 'General case' 0 CA--C 1.542 0.653 0 O-C-N 122.162 -0.336 . . . . 0.0 110.716 178.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.42 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.39 -41.44 63.36 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.836 0.854 . . . . 0.0 109.227 178.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 45.7 t -65.37 -54.44 28.57 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pp -54.75 -31.87 59.1 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-O 118.198 -0.906 . . . . 0.0 112.485 -179.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -53.52 -45.4 69.72 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 119.888 1.222 . . . . 0.0 109.682 178.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -36.1 73.55 Favored 'General case' 0 C--N 1.344 0.352 0 CA-C-N 119.163 0.892 . . . . 0.0 108.814 178.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -56.87 -35.76 69.28 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.228 0.922 . . . . 0.0 110.861 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.7 mm -60.06 -36.69 69.08 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.577 0 CA-C-N 120.152 1.342 . . . . 0.0 109.349 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.3 mttt -74.37 -32.18 62.66 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 126.683 1.993 . . . . 0.0 109.474 178.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -71.38 -49.78 38.69 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -33.65 75.99 Favored 'General case' 0 C--O 1.223 -0.295 0 CA-C-N 118.496 0.589 . . . . 0.0 112.328 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.6 tt -77.84 -45.74 27.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.892 -1.13 . . . . 0.0 110.18 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -69.95 -48.77 57.04 Favored 'General case' 0 C--O 1.224 -0.261 0 O-C-N 121.499 -0.751 . . . . 0.0 111.839 -177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 -78.76 -52.39 8.44 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 117.843 0.292 . . . . 0.0 110.756 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.7 t 48.86 29.53 2.34 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.885 1.674 . . . . 0.0 113.153 -178.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.2 pp -138.32 -177.67 4.95 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 127.803 2.441 . . . . 0.0 108.361 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 50.4 m -126.7 -53.92 1.44 Allowed 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 124.787 1.235 . . . . 0.0 110.608 179.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . 0.252 3.6 t -136.48 32.66 2.79 Favored 'General case' 0 C--O 1.221 -0.395 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 64.61 4.37 2.29 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 127.962 2.505 . . . . 0.0 115.275 -179.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 mttt -21.7 -73.49 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 128.085 2.554 . . . . 0.0 113.653 -178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -148.84 44.65 1.0 Allowed 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 106.404 -1.702 . . . . 0.0 106.404 177.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 56.49 -117.53 9.51 Favored Glycine 0 CA--C 1.527 0.801 0 N-CA-C 109.856 -1.298 . . . . 0.0 109.856 -179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.2 t -124.77 -62.69 1.22 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.197 1.399 . . . . 0.0 110.845 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 175.9 177.13 44.69 Favored Glycine 0 CA--C 1.526 0.719 0 O-C-N 120.824 -1.172 . . . . 0.0 111.82 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -73.59 -77.48 0.11 Allowed 'General case' 0 C--O 1.24 0.569 0 C-N-CA 124.271 1.028 . . . . 0.0 113.606 -179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.05 -123.2 1.15 Allowed Glycine 0 C--N 1.336 0.534 0 O-C-N 121.024 -1.048 . . . . 0.0 111.386 -179.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 49.1 p -158.3 -168.57 2.5 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.384 1.074 . . . . 0.0 109.896 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -125.08 178.48 16.52 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.954 2.216 . . . . 0.0 108.693 178.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 49.5 m -103.17 -167.02 1.33 Allowed 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 125.162 1.385 . . . . 0.0 109.596 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -151.57 154.73 25.73 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 107.179 -2.368 . . . . 0.0 107.179 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p -76.08 -69.45 0.5 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.215 1.006 . . . . 0.0 110.024 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 155.98 178.2 29.93 Favored Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.351 -1.499 . . . . 0.0 109.351 -179.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 5.7 p -121.69 5.36 10.02 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.415 1.486 . . . . 0.0 112.346 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -168.55 -177.92 39.86 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 p -135.88 -175.5 3.99 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.705 1.602 . . . . 0.0 109.191 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 53.86 30.22 44.24 Favored Glycine 0 CA--C 1.53 1.025 0 C-N-CA 123.966 0.793 . . . . 0.0 113.835 179.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.3 p -139.67 -78.18 0.32 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.711 1.204 . . . . 0.0 108.096 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 103.34 -175.11 23.49 Favored Glycine 0 CA--C 1.526 0.768 0 C-N-CA 123.587 0.613 . . . . 0.0 111.66 179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.7 t -154.38 158.06 39.49 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 125.518 1.527 . . . . 0.0 107.856 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 157.78 96.23 0.12 Allowed Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.061 -1.616 . . . . 0.0 109.061 179.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 38.1 m -137.4 162.72 32.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.239 1.816 . . . . 0.0 108.959 179.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 158.22 -164.57 33.44 Favored Glycine 0 CA--C 1.528 0.874 0 N-CA-C 109.752 -1.339 . . . . 0.0 109.752 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t 77.94 170.31 0.21 Allowed 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 126.993 2.117 . . . . 0.0 111.067 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 115.1 121.14 3.44 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.51 -2.236 . . . . 0.0 107.51 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 77.3 p -153.68 158.82 41.62 Favored 'General case' 0 C--O 1.239 0.505 0 CA-C-N 117.695 0.748 . . . . 0.0 110.214 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 151.84 -112.85 0.55 Allowed Glycine 0 N--CA 1.447 -0.595 0 C-N-CA 126.21 1.862 . . . . 0.0 109.076 179.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 50.2 p90 -67.65 -168.97 0.1 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.029 1.331 . . . . 0.0 113.176 -179.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -62.73 178.53 0.44 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.499 1.52 . . . . 0.0 110.735 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 31.8 mt -104.93 95.51 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 105.204 -2.147 . . . . 0.0 105.204 179.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -69.53 -6.52 31.34 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.753 1.621 . . . . 0.0 111.923 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.4 t -126.38 38.61 4.1 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.537 1.535 . . . . 0.0 112.869 -178.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 9.2 t80 -144.62 -85.19 0.13 Allowed 'General case' 0 C--N 1.342 0.256 0 O-C-N 121.046 -1.034 . . . . 0.0 108.598 179.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -85.04 7.7 20.52 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 124.675 1.19 . . . . 0.0 112.944 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.83 -25.08 7.04 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 35.6 mm-40 -70.9 -46.85 61.81 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 124.709 1.204 . . . . 0.0 111.36 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 3.6 p30 -79.79 -27.0 40.42 Favored 'General case' 0 N--CA 1.466 0.373 0 C-N-CA 122.3 0.24 . . . . 0.0 111.171 178.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -56.83 -45.38 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 124.92 1.288 . . . . 0.0 112.35 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -61.47 -39.07 89.57 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 3.9 m -67.65 -39.15 84.59 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 124.914 1.286 . . . . 0.0 111.128 -178.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 30.3 t -68.75 -51.67 43.14 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.55 0 C-N-CA 126.426 1.891 . . . . 0.0 107.663 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.468 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -64.59 -34.55 78.52 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.614 -1.304 . . . . 0.0 110.926 -179.103 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 41.7 mtpt -58.79 -27.46 65.04 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 124.734 1.214 . . . . 0.0 110.285 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.28 -43.55 66.94 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.493 0.588 . . . . 0.0 109.832 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 40.7 mt -76.63 -29.08 56.33 Favored 'General case' 0 CA--C 1.513 -0.449 0 N-CA-C 117.954 2.576 . . . . 0.0 117.954 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -60.6 -17.82 49.13 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.371 0.878 . . . . 0.0 113.371 -178.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 14.8 p30 -100.53 -6.13 25.89 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.334 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.59 153.9 24.07 Favored 'General case' 0 C--N 1.344 0.364 0 CA-C-N 119.291 0.95 . . . . 0.0 109.855 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.66 173.9 9.21 Favored 'General case' 0 N--CA 1.466 0.332 0 C-N-CA 125.086 1.354 . . . . 0.0 110.803 179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -60.0 -43.09 95.41 Favored 'General case' 0 C--O 1.213 -0.858 0 O-C-N 120.853 -1.155 . . . . 0.0 108.319 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -52.09 -31.8 32.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 124.407 1.083 . . . . 0.0 111.138 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -81.67 -52.96 6.63 Favored 'General case' 0 N--CA 1.432 -1.334 0 O-C-N 119.997 -1.689 . . . . 0.0 111.469 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.3 mt -76.32 -54.49 6.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -55.73 -39.65 71.39 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 128.009 2.523 . . . . 0.0 106.576 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -68.96 -26.67 65.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 119.661 -0.815 . . . . 0.0 112.752 -179.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.92 -55.44 5.47 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 120.967 -1.083 . . . . 0.0 110.564 -178.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.42 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -59.75 -38.73 82.58 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -77.4 -26.67 51.98 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 123.692 0.62 . . . . 0.0 112.469 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.78 5.43 88.52 Favored Glycine 0 CA--C 1.534 1.272 0 C-N-CA 126.188 1.851 . . . . 0.0 112.69 -179.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -87.35 -166.77 1.67 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 127.048 2.139 . . . . 0.0 108.191 179.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -123.71 19.8 9.43 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.704 1.602 . . . . 0.0 111.695 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 58.2 mm-40 . . . . . 0 C--O 1.248 1.022 0 N-CA-C 104.901 -2.259 . . . . 0.0 104.901 178.818 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.3 ttm . . . . . 0 N--CA 1.467 0.424 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.42 27.25 3.43 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.712 0.405 . . . . 0.0 111.276 -179.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 5.9 tt -155.7 168.78 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 -179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -140.56 -48.25 0.43 Allowed 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 126.706 2.002 . . . . 0.0 108.037 179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 56.2 mt-10 -58.85 -40.89 85.63 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 124.362 1.065 . . . . 0.0 110.54 -179.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 70.8 mt-30 -77.65 -26.97 50.84 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.162 -0.961 . . . . 0.0 110.33 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 97.1 m -67.48 -32.63 73.6 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 117.433 -1.27 . . . . 0.0 110.034 179.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.1 mt -53.24 -29.42 32.48 Favored 'General case' 0 C--O 1.219 -0.551 0 CA-C-N 120.586 1.539 . . . . 0.0 107.779 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -52.59 -46.01 66.74 Favored 'General case' 0 C--N 1.339 0.132 0 CA-C-N 119.229 0.922 . . . . 0.0 111.593 179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.4 ptmt -66.86 -28.11 68.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.682 0.674 . . . . 0.0 109.953 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.591 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -76.42 -54.48 6.67 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.228 1.011 . . . . 0.0 110.535 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -40.76 86.14 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 119.892 -1.755 . . . . 0.0 111.723 -178.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -64.21 -31.21 72.32 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.351 0.523 . . . . 0.0 109.962 178.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.77 -43.48 62.78 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 HG23 HD23 ' A' 3316 ' ' LEU . 58.2 t -66.52 -50.31 67.92 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.153 0 CA-C-N 118.736 0.698 . . . . 0.0 110.463 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pp -52.74 -32.85 45.43 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 118.653 0.661 . . . . 0.0 111.989 -178.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 -58.44 -37.46 75.47 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.755 0.707 . . . . 0.0 111.846 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.25 -34.97 59.18 Favored 'General case' 0 C--N 1.344 0.36 0 CA-C-N 120.459 1.481 . . . . 0.0 110.007 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -56.78 -34.74 67.94 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.899 0.88 . . . . 0.0 111.36 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 6.7 mm -58.96 -44.99 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.112 0.869 . . . . 0.0 109.288 179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 40.0 mttm -65.17 -29.52 70.35 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 125.514 1.526 . . . . 0.0 109.798 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -74.51 -50.26 18.84 Favored 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.534 179.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.44 -35.38 80.73 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 119.029 0.832 . . . . 0.0 112.271 -179.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 tt -73.47 -44.38 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-N 119.452 1.024 . . . . 0.0 111.34 179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 -76.2 -47.98 22.11 Favored 'General case' 0 C--N 1.34 0.188 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 -177.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -77.5 -51.26 11.02 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.5 t 51.48 29.81 5.71 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.15 1.38 . . . . 0.0 112.237 -179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.12 -173.47 3.67 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 126.41 1.884 . . . . 0.0 111.1 -178.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 14.8 m -125.77 -70.81 0.72 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 125.63 1.572 . . . . 0.0 108.091 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -119.41 34.69 5.12 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.721 1.609 . . . . 0.0 111.427 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 57.49 36.75 27.3 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.6 148.83 11.69 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.306 0.643 . . . . 0.0 110.771 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -82.17 171.01 14.79 Favored 'General case' 0 C--N 1.322 -0.588 0 C-N-CA 123.753 0.821 . . . . 0.0 108.807 178.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 98.84 106.57 2.65 Favored Glycine 0 C--N 1.335 0.494 0 C-N-CA 124.844 1.212 . . . . 0.0 112.58 178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 t -140.63 -7.95 1.1 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.919 1.688 . . . . 0.0 111.602 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -70.7 129.47 19.12 Favored Glycine 0 CA--C 1.525 0.71 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 t -175.96 -169.48 0.33 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 127.781 2.432 . . . . 0.0 107.227 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 98.85 111.99 3.2 Favored Glycine 0 C--N 1.332 0.335 0 N-CA-C 108.388 -1.885 . . . . 0.0 108.388 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 17.4 m -140.45 158.04 44.6 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.678 0.791 . . . . 0.0 108.869 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -164.44 173.37 40.39 Favored Glycine 0 CA--C 1.519 0.305 0 N-CA-C 110.568 -1.013 . . . . 0.0 110.568 -179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.4 t -147.67 -50.35 0.18 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.378 1.071 . . . . 0.0 108.909 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 78.26 -58.81 4.02 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 2.9 p 57.73 -1.83 0.07 Allowed 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 127.747 2.419 . . . . 0.0 116.331 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -164.96 169.3 39.54 Favored Glycine 0 CA--C 1.525 0.667 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.7 t -168.54 -173.65 1.98 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 126.658 1.983 . . . . 0.0 106.576 179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 74.01 15.07 79.91 Favored Glycine 0 CA--C 1.53 0.994 0 CA-C-O 119.257 -0.746 . . . . 0.0 114.051 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.2 t -150.17 169.86 20.31 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 118.97 1.385 . . . . 0.0 108.883 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 93.04 143.6 13.26 Favored Glycine 0 CA--C 1.529 0.926 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -178.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.7 p -160.6 101.35 1.33 Allowed 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.818 -0.813 . . . . 0.0 109.506 -179.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 161.77 170.69 26.84 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.0 p -179.19 178.16 0.74 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.666 2.386 . . . . 0.0 107.728 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 169.58 -171.05 43.07 Favored Glycine 0 CA--C 1.524 0.624 0 C-N-CA 125.677 1.608 . . . . 0.0 110.421 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.4 p -162.8 157.07 20.99 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 126.017 1.727 . . . . 0.0 108.426 -179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -136.37 157.65 23.64 Favored Glycine 0 CA--C 1.527 0.832 0 N-CA-C 108.178 -1.969 . . . . 0.0 108.178 178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.9 t -134.23 -164.55 1.52 Allowed 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.036 1.334 . . . . 0.0 110.698 -178.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -174.22 161.0 30.94 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.646 1.593 . . . . 0.0 109.6 179.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.6 t -160.47 -175.9 5.28 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.6 1.56 . . . . 0.0 108.239 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 69.62 -94.77 0.43 Allowed Glycine 0 C--N 1.336 0.581 0 N-CA-C 108.708 -1.757 . . . . 0.0 108.708 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.401 ' H ' ' HD1' ' A' ' 59' ' ' TYR . 0.1 OUTLIER -84.08 176.63 8.68 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 126.381 1.872 . . . . 0.0 109.994 178.737 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -77.84 175.78 9.68 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 121.23 -0.919 . . . . 0.0 111.19 179.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 13.9 mt -74.07 93.94 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 C-N-CA 125.551 1.541 . . . . 0.0 109.975 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 19.8 tt0 -66.03 -14.52 61.82 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.59 0.71 . . . . 0.0 111.651 179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.2 t -111.93 43.88 1.49 Allowed 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.743 1.217 . . . . 0.0 111.91 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -155.35 -57.0 0.1 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.37 -0.831 . . . . 0.0 111.152 179.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -122.8 11.46 9.71 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 123.977 0.911 . . . . 0.0 113.094 -178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.93 -25.56 12.24 Favored 'General case' 0 N--CA 1.464 0.274 0 O-C-N 120.881 -1.137 . . . . 0.0 113.441 -179.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 47.7 mm-40 -68.21 -48.09 66.13 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.711 0.804 . . . . 0.0 110.985 179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.97 -25.81 40.23 Favored 'General case' 0 N--CA 1.464 0.273 0 O-C-N 121.517 -0.739 . . . . 0.0 111.562 178.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.35 -45.84 97.05 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.324 0 C-N-CA 123.886 0.875 . . . . 0.0 109.797 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.26 -32.79 74.28 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 -179.626 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 42.0 m -72.17 -44.31 63.24 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 124.114 0.966 . . . . 0.0 111.784 -178.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 6.3 p -75.92 -39.12 37.17 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.436 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.9 -31.0 71.68 Favored 'General case' 0 CA--C 1.518 -0.262 0 O-C-N 120.197 -1.564 . . . . 0.0 110.016 179.43 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 19.2 mtpp -60.29 -28.62 68.23 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 123.318 0.647 . . . . 0.0 109.357 178.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -70.12 -46.05 65.59 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 178.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 89.1 mt -68.6 -39.65 80.77 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 -178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -61.92 -26.25 68.06 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 119.239 0.927 . . . . 0.0 112.289 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.7 p30 -96.05 6.76 48.1 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 118.728 0.695 . . . . 0.0 111.256 -179.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -96.73 154.38 17.32 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 178.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.8 m -85.3 170.02 13.18 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.23 1.012 . . . . 0.0 111.252 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -57.12 -50.2 73.52 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.344 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -52.22 -28.0 16.86 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 120.228 1.376 . . . . 0.0 113.129 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -79.92 -51.83 8.61 Favored 'General case' 0 N--CA 1.44 -0.97 0 O-C-N 121.507 -0.745 . . . . 0.0 109.522 178.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -76.16 -53.74 7.85 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 126.294 1.837 . . . . 0.0 115.214 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.43 -41.03 68.91 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 128.357 2.663 . . . . 0.0 105.913 178.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.25 -26.84 68.28 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 118.604 0.638 . . . . 0.0 112.447 -178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 8.3 mmm -79.16 -55.65 4.95 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-O 122.017 0.913 . . . . 0.0 111.893 -178.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.591 HD21 HD12 ' A' ' 11' ' ' LEU . 2.5 pp -61.65 -34.79 76.3 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.63 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -82.57 -25.94 32.82 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.622 0.769 . . . . 0.0 109.664 179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.81 56.83 22.02 Favored Glycine 0 C--N 1.338 0.65 0 C-N-CA 127.569 2.509 . . . . 0.0 109.255 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.05 177.88 7.92 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 127.399 2.28 . . . . 0.0 110.964 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -128.18 90.64 3.12 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 178.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.7 pp0? . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.039 -1.437 . . . . 0.0 109.801 177.836 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 N--CA 1.475 0.807 0 CA-C-O 119.055 -0.497 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 64.6 m-80 -70.19 12.84 0.19 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 126.145 1.778 . . . . 0.0 112.314 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.437 HG13 ' H ' ' A' ' 6' ' ' GLN . 10.2 tp -164.15 168.39 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.754 0 C-N-CA 127.984 2.513 . . . . 0.0 107.069 -179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -137.25 -44.9 0.56 Allowed 'General case' 0 C--O 1.221 -0.408 0 C-N-CA 127.432 2.293 . . . . 0.0 107.675 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 87.1 mt-10 -59.59 -38.59 81.61 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.653 1.181 . . . . 0.0 110.423 179.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.437 ' H ' HG13 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -76.84 -30.63 56.42 Favored 'General case' 0 C--N 1.33 -0.263 0 O-C-N 121.368 -0.833 . . . . 0.0 109.168 178.55 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.6 m -60.14 -35.04 74.4 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 117.761 -1.114 . . . . 0.0 111.349 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.541 ' HA ' HD23 ' A' ' 11' ' ' LEU . 19.9 mt -51.82 -28.66 16.45 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 126.33 1.852 . . . . 0.0 109.141 -178.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -51.39 -43.81 62.01 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.583 1.153 . . . . 0.0 111.181 179.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.464 ' HG2' HD22 ' A' ' 11' ' ' LEU . 15.3 ptmt -69.63 -28.53 65.99 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 121.623 -0.673 . . . . 0.0 110.706 179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.599 HD12 HD21 ' A' 3316 ' ' LEU . 3.1 mm? -75.77 -54.24 7.25 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 125.583 1.553 . . . . 0.0 110.338 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.87 -44.5 86.66 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.345 -1.472 . . . . 0.0 111.154 -178.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -61.94 -32.15 72.54 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-O 121.173 0.511 . . . . 0.0 110.445 178.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.582 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.53 -35.97 68.19 Favored 'General case' 0 N--CA 1.454 -0.227 0 O-C-N 120.41 -1.431 . . . . 0.0 110.723 179.641 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.533 HG23 HD23 ' A' 3316 ' ' LEU . 97.5 t -72.7 -50.01 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.611 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.82 -34.36 67.63 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.906 -1.045 . . . . 0.0 110.148 179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -53.06 -49.14 66.98 Favored 'General case' 0 C--N 1.344 0.343 0 CA-C-N 119.402 1.001 . . . . 0.0 109.974 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.87 -38.91 80.01 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 119.943 1.247 . . . . 0.0 110.059 178.64 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mttm -55.21 -38.65 68.68 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-N 119.444 1.02 . . . . 0.0 111.171 -179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.425 ' O ' HG22 ' A' ' 24' ' ' ILE . 5.7 mm -59.63 -40.04 81.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 119.286 0.948 . . . . 0.0 109.848 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -69.13 -30.89 69.24 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 125.324 1.45 . . . . 0.0 110.62 179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -74.1 -49.99 21.51 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 118.67 -0.681 . . . . 0.0 110.216 -179.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -37.32 81.0 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 118.612 0.642 . . . . 0.0 111.793 -179.344 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.1 tt -75.36 -45.95 39.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.284 0.947 . . . . 0.0 111.101 179.683 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 41.4 tt0 -72.15 -47.59 49.81 Favored 'General case' 0 N--CA 1.456 -0.171 0 O-C-N 121.551 -0.718 . . . . 0.0 112.603 -177.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.7 m-80 -79.1 -52.49 8.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 122.58 0.352 . . . . 0.0 110.76 -179.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 45.31 41.92 6.75 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.84 1.256 . . . . 0.0 110.576 -178.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.628 HD13 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -153.07 177.32 10.93 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.49 1.516 . . . . 0.0 108.1 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 66.3 m -112.76 -70.48 0.8 Allowed 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 124.459 1.104 . . . . 0.0 110.023 179.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.0 t -125.92 51.75 1.73 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 125.91 1.684 . . . . 0.0 110.686 -177.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.628 ' H ' HD13 ' A' ' 28' ' ' LEU . 92.6 mt-10 54.81 43.7 29.61 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.99 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.64 179.52 1.04 Allowed 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 -179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -145.7 172.58 13.08 Favored 'General case' 0 C--O 1.234 0.281 0 O-C-N 120.92 -1.113 . . . . 0.0 109.758 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 137.69 106.75 0.77 Allowed Glycine 0 CA--C 1.524 0.597 0 N-CA-C 108.181 -1.968 . . . . 0.0 108.181 -179.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.9 t -128.85 -179.2 4.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 126.664 1.986 . . . . 0.0 109.594 -179.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 98.72 137.99 10.06 Favored Glycine 0 CA--C 1.523 0.562 0 C-N-CA 124.92 1.248 . . . . 0.0 110.455 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.7 t -142.59 179.97 6.66 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 126.729 2.012 . . . . 0.0 108.275 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -132.61 172.97 21.06 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 108.873 -1.691 . . . . 0.0 108.873 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.1 p -148.45 175.23 11.3 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 125.326 1.451 . . . . 0.0 107.265 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 166.2 -168.63 39.98 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.034 -1.626 . . . . 0.0 109.034 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 17.7 t -148.86 153.74 38.49 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 150.19 165.11 12.32 Favored Glycine 0 CA--C 1.526 0.723 0 C-N-CA 124.686 1.136 . . . . 0.0 110.325 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 10.0 p -81.34 117.3 21.7 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.205 1.002 . . . . 0.0 110.057 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.01 -97.51 0.17 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 178.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 63.26 -0.4 0.66 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 126.402 1.881 . . . . 0.0 115.26 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -66.46 147.76 50.12 Favored Glycine 0 CA--C 1.528 0.862 0 CA-C-N 119.276 0.944 . . . . 0.0 110.847 179.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.3 p 179.63 165.33 1.09 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 128.327 2.651 . . . . 0.0 107.082 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 177.61 -172.1 44.8 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.241 -0.743 . . . . 0.0 111.241 -179.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 p -153.42 -56.98 0.12 Allowed 'General case' 0 C--O 1.235 0.325 0 C-N-CA 124.174 0.989 . . . . 0.0 110.698 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -176.06 177.73 47.63 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 126.692 2.092 . . . . 0.0 109.458 -179.608 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 14.2 p -147.55 173.88 12.27 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.409 1.884 . . . . 0.0 107.075 179.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -159.29 -163.67 13.52 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.053 -1.619 . . . . 0.0 109.053 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 69.6 m -152.85 140.75 20.16 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.983 -1.304 . . . . 0.0 109.544 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -165.96 162.69 36.18 Favored Glycine 0 C--O 1.24 0.523 0 C-N-CA 125.211 1.386 . . . . 0.0 110.116 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.6 t -102.88 145.02 30.43 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -114.02 175.03 15.99 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 125.39 1.472 . . . . 0.0 109.92 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 4.4 p -156.03 151.7 27.19 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 67.77 -166.8 42.71 Favored Glycine 0 CA--C 1.524 0.636 0 CA-C-O 122.149 0.86 . . . . 0.0 113.018 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -68.86 33.16 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 127.56 2.344 . . . . 0.0 114.791 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.4 pt20 -77.55 -175.83 3.99 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 120.71 -1.244 . . . . 0.0 111.238 179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.7 mt -117.37 88.7 1.23 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 125.376 1.47 . . . . 0.0 107.459 -179.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.92 -10.99 15.52 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 -178.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.8 t -122.29 42.87 3.03 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.967 1.707 . . . . 0.0 111.275 -178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 11.6 t80 -150.68 -52.83 0.14 Allowed 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.701 0.8 . . . . 0.0 110.553 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -128.71 7.56 5.71 Favored 'General case' 0 C--O 1.231 0.081 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -177.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.07 -28.84 18.93 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.867 1.212 . . . . 0.0 113.152 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 2.1 mm-40 -67.98 -41.02 82.97 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.253 0.621 . . . . 0.0 111.051 179.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 22.9 t70 -81.54 -27.76 34.24 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.301 1.04 . . . . 0.0 110.995 178.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -55.68 -38.61 51.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.298 0 C-N-CA 124.68 1.192 . . . . 0.0 111.187 -179.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.15 -37.49 87.43 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.142 -1.059 . . . . 0.0 108.142 179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 2.8 m -69.23 -42.42 75.68 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.505 1.522 . . . . 0.0 110.178 -178.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 54.6 t -64.84 -49.99 77.34 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 C-N-CA 124.528 1.131 . . . . 0.0 108.068 179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.451 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -67.35 -33.14 74.62 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.949 -179.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -63.54 -28.26 69.82 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.243 1.017 . . . . 0.0 108.809 178.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.21 -41.39 66.97 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 19.1 mt -78.94 -30.73 44.8 Favored 'General case' 0 CA--C 1.517 -0.307 0 N-CA-C 118.044 2.609 . . . . 0.0 118.044 -177.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 22.6 pt-20 -63.75 -11.93 30.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 119.232 0.924 . . . . 0.0 112.97 -179.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 16.6 p30 -103.84 -2.68 25.92 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.698 0.799 . . . . 0.0 109.753 177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -91.06 153.41 20.14 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 118.88 0.764 . . . . 0.0 109.854 178.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 19.8 m -86.36 169.16 13.18 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 127.972 2.509 . . . . 0.0 110.826 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -58.37 -46.46 86.28 Favored 'General case' 0 C--O 1.205 -1.267 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -52.08 -33.46 39.4 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 128.127 2.571 . . . . 0.0 110.324 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -81.12 -51.73 8.14 Favored 'General case' 0 N--CA 1.441 -0.882 0 C-N-CA 123.686 0.794 . . . . 0.0 112.867 178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.8 -53.92 7.74 Favored 'General case' 0 N--CA 1.462 0.131 0 C-N-CA 126.719 2.008 . . . . 0.0 113.389 -177.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -54.72 -37.24 65.62 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 127.844 2.458 . . . . 0.0 106.549 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.65 -28.64 69.75 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 119.114 0.87 . . . . 0.0 112.101 178.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 4.5 mmm -79.69 -55.57 4.92 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 120.672 -1.268 . . . . 0.0 109.942 -179.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.599 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -66.42 -38.14 86.79 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.52 0.728 . . . . 0.0 111.753 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -83.86 -22.18 31.76 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 118.871 0.759 . . . . 0.0 111.394 179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.55 11.07 85.66 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.746 1.165 . . . . 0.0 114.55 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -97.27 -174.03 2.83 Favored 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 126.61 1.964 . . . . 0.0 111.141 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -129.82 32.24 4.6 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 125.753 1.621 . . . . 0.0 112.887 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 44.4 mm-40 . . . . . 0 C--O 1.236 0.361 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 179.238 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.1 mmm . . . . . 0 N--CA 1.478 0.948 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -59.02 161.73 4.83 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 124.852 1.261 . . . . 0.0 112.749 -178.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.8 tt -56.05 124.01 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 CA-C-N 113.681 -1.599 . . . . 0.0 109.456 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -95.27 -39.61 9.98 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 114.483 -1.235 . . . . 0.0 111.436 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.0 mt-10 -59.33 -39.51 83.36 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 126.054 1.742 . . . . 0.0 111.303 -178.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -72.67 -29.51 63.49 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.809 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 89.6 m -72.19 -34.62 68.55 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-O 117.877 -1.058 . . . . 0.0 110.307 179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mt -53.67 -29.21 37.59 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 120.118 1.326 . . . . 0.0 107.634 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -52.7 -44.04 66.02 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.869 1.268 . . . . 0.0 111.671 179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -69.9 -28.89 66.0 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 121.597 -0.689 . . . . 0.0 109.783 178.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3316 ' ' LEU . 3.2 mm? -75.8 -54.34 7.07 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 124.934 1.294 . . . . 0.0 110.484 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -44.65 75.89 Favored 'General case' 0 CA--C 1.514 -0.424 0 O-C-N 120.347 -1.47 . . . . 0.0 111.875 -178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -63.38 -31.29 72.4 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-O 120.882 0.372 . . . . 0.0 110.87 178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.599 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.52 -35.97 65.64 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 120.74 -1.225 . . . . 0.0 110.172 179.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.458 HG23 HD23 ' A' 3316 ' ' LEU . 54.9 t -73.74 -53.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.231 0.121 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.2 pp -52.44 -31.99 37.22 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 118.586 0.63 . . . . 0.0 111.59 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -53.44 -45.21 69.37 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.331 0.968 . . . . 0.0 110.616 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.84 -36.02 75.22 Favored 'General case' 0 N--CA 1.467 0.388 0 O-C-N 120.522 -1.361 . . . . 0.0 109.285 178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.6 mttm -55.16 -33.03 62.59 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 124.267 1.027 . . . . 0.0 111.086 179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.6 mm -57.88 -46.99 87.33 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.111 0 CA-C-N 118.994 0.815 . . . . 0.0 109.229 179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.7 mtmt -69.43 -29.17 66.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.49 1.516 . . . . 0.0 110.417 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 59.1 mt-10 -74.04 -50.25 20.59 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.628 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.75 -36.71 83.94 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 119.026 0.83 . . . . 0.0 111.926 -179.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 tt -72.93 -46.45 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.265 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -75.92 -48.5 21.04 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 -177.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -70.56 -51.92 25.2 Favored 'General case' 0 CA--C 1.519 -0.25 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -178.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 48.98 26.28 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 124.588 1.155 . . . . 0.0 112.117 -178.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.815 HD13 ' H ' ' A' ' 31' ' ' GLU . 4.0 pp -139.48 161.37 37.64 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 126.143 1.777 . . . . 0.0 108.008 -178.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 18.7 m -91.25 -42.59 10.32 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 125.391 1.476 . . . . 0.0 113.042 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.8 t -163.48 38.43 0.09 Allowed 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.462 1.125 . . . . 0.0 108.423 -179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.815 ' H ' HD13 ' A' ' 28' ' ' LEU . 32.7 mt-10 68.99 13.4 8.79 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.433 1.493 . . . . 0.0 112.083 -179.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -50.94 146.7 5.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 128.214 2.605 . . . . 0.0 109.481 179.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 93.7 m-85 50.86 26.48 2.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.726 1.21 . . . . 0.0 113.269 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -45.1 108.87 0.23 Allowed Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.809 1.671 . . . . 0.0 113.194 -179.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 58.24 15.63 3.47 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.435 1.494 . . . . 0.0 112.754 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -92.53 148.59 19.18 Favored Glycine 0 N--CA 1.449 -0.496 0 O-C-N 120.75 -1.219 . . . . 0.0 112.336 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.8 p -147.83 -103.62 0.09 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 64.79 -157.86 45.02 Favored Glycine 0 CA--C 1.53 1.022 0 CA-C-N 118.85 0.75 . . . . 0.0 111.507 179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.1 m -74.52 -179.43 4.03 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.227 1.011 . . . . 0.0 111.049 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -119.75 159.45 14.87 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 108.201 -1.96 . . . . 0.0 108.201 178.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.1 t -147.66 -1.1 0.62 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.269 1.028 . . . . 0.0 113.041 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 161.74 -12.82 0.13 Allowed Glycine 0 CA--C 1.533 1.173 0 CA-C-N 120.476 1.489 . . . . 0.0 115.348 179.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 p 46.31 28.96 0.77 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 127.307 2.243 . . . . 0.0 116.238 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -67.7 148.42 49.49 Favored Glycine 0 CA--C 1.527 0.797 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.689 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.3 m -158.87 -6.83 0.07 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.576 1.15 . . . . 0.0 113.823 179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.03 -164.41 31.1 Favored Glycine 0 CA--C 1.527 0.795 0 CA-C-N 120.22 1.373 . . . . 0.0 110.135 -179.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -144.33 165.8 26.88 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 124.369 1.067 . . . . 0.0 108.6 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -94.25 -162.5 35.43 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 125.365 1.459 . . . . 0.0 113.585 -179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 58.2 m -147.64 -170.01 3.46 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 128.202 2.601 . . . . 0.0 108.651 -179.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 176.97 -86.94 0.07 OUTLIER Glycine 0 CA--C 1.523 0.564 0 N-CA-C 108.582 -1.807 . . . . 0.0 108.582 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 7.0 t 45.91 81.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.558 2.343 . . . . 0.0 111.896 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.01 171.68 16.39 Favored Glycine 0 CA--C 1.526 0.726 0 N-CA-C 111.995 -0.442 . . . . 0.0 111.995 -179.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.7 m -68.43 -48.74 63.81 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 124.544 1.138 . . . . 0.0 112.543 -179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 170.22 152.01 7.78 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 110.51 -1.036 . . . . 0.0 110.51 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.6 p -86.07 -176.46 5.96 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 125.329 1.452 . . . . 0.0 112.007 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -161.98 -178.77 36.16 Favored Glycine 0 CA--C 1.53 0.98 0 C-N-CA 129.029 3.204 . . . . 0.0 105.864 178.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 80.5 p -84.39 164.94 18.6 Favored 'General case' 0 C--O 1.239 0.534 0 CA-C-N 118.588 1.194 . . . . 0.0 111.433 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.46 164.1 27.75 Favored Glycine 0 CA--C 1.521 0.43 0 N-CA-C 109.155 -1.578 . . . . 0.0 109.155 178.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -74.4 -4.97 39.7 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.908 -0.76 . . . . 0.0 112.971 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -71.4 172.35 9.62 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.124 -0.985 . . . . 0.0 112.789 -179.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 17.6 mt -79.47 102.89 5.84 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.671 1.588 . . . . 0.0 108.229 179.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -65.42 -9.87 28.96 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.4 t -126.5 40.83 3.65 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.298 1.039 . . . . 0.0 112.25 -178.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 16.2 t80 -143.78 -42.04 0.28 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 121.048 -1.033 . . . . 0.0 112.731 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.74 9.96 1.79 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.093 1.357 . . . . 0.0 111.874 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.65 -32.91 20.52 Favored 'General case' 0 C--O 1.227 -0.11 0 C-N-CA 123.962 0.905 . . . . 0.0 112.635 -179.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 46.8 mm-40 -59.8 -45.48 92.21 Favored 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.718 0.636 . . . . 0.0 110.718 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -80.38 -34.19 36.61 Favored 'General case' 0 CA--C 1.518 -0.253 0 O-C-N 121.892 -0.505 . . . . 0.0 111.621 178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.01 -44.33 90.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.577 0 C-N-CA 124.092 0.957 . . . . 0.0 110.971 -179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.23 -36.2 77.18 Favored 'General case' 0 C--O 1.221 -0.432 0 O-C-N 123.509 0.506 . . . . 0.0 109.78 -179.107 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.1 t -67.17 -47.4 71.1 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.26 1.024 . . . . 0.0 111.485 -178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 14.3 p -76.21 -45.39 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 119.349 -0.94 . . . . 0.0 109.251 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.419 ' HA ' HD13 ' A' 3304 ' ' LEU . 0.0 OUTLIER -57.99 -30.46 66.08 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 119.971 1.26 . . . . 0.0 111.984 -178.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 11.1 mtpp -55.82 -27.25 50.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.7 1.2 . . . . 0.0 110.157 177.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . 0.486 ' HG2' HD12 ' A' 3304 ' ' LEU . 3.9 pt-20 -77.57 -40.94 40.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 122.144 0.973 . . . . 0.0 109.306 178.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . 0.486 HD12 ' HG2' ' A' 3303 ' ' GLU . 4.3 mp -67.77 -34.66 77.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 114.339 1.237 . . . . 0.0 114.339 -177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -64.27 -14.9 58.66 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -113.99 -1.11 13.87 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 123.749 0.82 . . . . 0.0 111.059 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.68 152.5 28.4 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.337 0.517 . . . . 0.0 109.82 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 5.7 m -82.02 167.19 19.1 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.539 1.136 . . . . 0.0 111.439 -179.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -58.3 -50.9 71.97 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -52.3 -27.81 16.64 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 120.199 1.363 . . . . 0.0 112.845 -178.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -80.33 -51.36 8.98 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 121.365 -0.834 . . . . 0.0 109.691 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.7 mt -76.86 -53.62 7.65 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 126.004 1.721 . . . . 0.0 114.388 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.26 -40.71 68.04 Favored 'General case' 0 CA--C 1.511 -0.555 0 C-N-CA 128.425 2.69 . . . . 0.0 106.866 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.94 -27.3 67.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 119.304 -0.958 . . . . 0.0 112.625 -178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 5.7 mmm -77.33 -55.28 5.54 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.587 -0.695 . . . . 0.0 110.711 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.599 HD22 ' HB3' ' A' ' 14' ' ' ALA . 2.6 pp -62.35 -32.94 73.8 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.935 0.494 . . . . 0.0 110.239 179.352 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -84.8 -17.97 36.49 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 118.003 0.365 . . . . 0.0 110.858 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 56.98 48.9 75.51 Favored Glycine 0 C--N 1.336 0.554 0 C-N-CA 126.391 1.948 . . . . 0.0 109.659 179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -139.17 -178.01 5.16 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.883 2.073 . . . . 0.0 108.691 -178.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -135.86 82.76 1.97 Allowed 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.787 -1.931 . . . . 0.0 105.787 178.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.245 0.827 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.472 0.647 0 CA-C-O 118.279 -0.867 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -83.44 45.63 1.07 Allowed 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 121.097 1.771 . . . . 0.0 110.996 -179.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 3.4 tp -159.82 171.16 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 125.207 1.403 . . . . 0.0 107.796 -179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -145.28 -49.14 0.24 Allowed 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.772 2.029 . . . . 0.0 107.416 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -58.87 -41.77 87.89 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 125.662 1.585 . . . . 0.0 112.464 -179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -76.39 -27.07 56.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 63.8 m -67.85 -34.62 77.06 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 117.578 -1.201 . . . . 0.0 110.399 178.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.6 mt -52.91 -28.83 25.15 Favored 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 120.01 1.277 . . . . 0.0 108.138 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -52.42 -43.18 64.67 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.565 1.146 . . . . 0.0 111.938 179.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -69.86 -28.38 65.62 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.348 0.522 . . . . 0.0 109.854 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.551 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.16 -54.67 6.48 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 124.578 1.151 . . . . 0.0 110.765 179.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.86 -41.09 77.34 Favored 'General case' 0 CA--C 1.512 -0.493 0 O-C-N 120.431 -1.418 . . . . 0.0 111.513 -179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -64.56 -31.81 73.18 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-N 118.019 0.372 . . . . 0.0 110.349 178.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.666 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.97 -44.7 65.48 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.562 -1.336 . . . . 0.0 108.671 178.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.48 HG23 HD23 ' A' 3316 ' ' LEU . 91.3 t -63.24 -51.68 68.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 179.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.8 pp -60.53 -32.78 71.8 Favored 'General case' 0 N--CA 1.466 0.328 0 O-C-N 120.55 -1.344 . . . . 0.0 112.492 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -55.03 -46.69 75.31 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 120.057 1.298 . . . . 0.0 110.126 179.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.55 -31.74 65.51 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 118.425 -1.31 . . . . 0.0 110.835 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.1 mttm -54.37 -34.84 62.01 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-O 117.436 -1.268 . . . . 0.0 109.752 -179.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.466 ' O ' HG22 ' A' ' 24' ' ' ILE . 9.2 mm -56.46 -48.58 79.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 119.346 0.975 . . . . 0.0 109.317 179.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -67.78 -30.67 70.17 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.173 0.989 . . . . 0.0 110.866 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -74.62 -49.26 22.26 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 121.429 -0.794 . . . . 0.0 110.127 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -37.61 79.35 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 118.471 -0.776 . . . . 0.0 112.888 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.466 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.6 tt -77.17 -46.79 28.14 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.244 0 C-N-CA 123.44 0.696 . . . . 0.0 110.709 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -70.44 -45.16 66.38 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.195 -0.941 . . . . 0.0 112.796 -177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -75.24 -51.73 12.6 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 49.52 29.08 2.77 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-O 122.432 1.111 . . . . 0.0 111.918 -179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 4.1 pp -140.46 -178.27 5.43 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 126.538 1.935 . . . . 0.0 109.706 -178.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 27.5 m -132.82 -35.32 1.09 Allowed 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.824 1.65 . . . . 0.0 112.338 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -154.18 33.28 0.43 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.455 1.502 . . . . 0.0 107.812 -178.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 59.42 22.87 11.38 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 120.541 -1.349 . . . . 0.0 112.327 -179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.2 ttmt -62.17 -32.25 72.86 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.554 1.942 . . . . 0.0 113.552 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -142.86 155.99 44.86 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 125.04 1.336 . . . . 0.0 108.71 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -175.83 -29.87 0.04 OUTLIER Glycine 0 CA--C 1.531 1.04 0 CA-C-O 118.451 -1.194 . . . . 0.0 114.299 179.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.6 m -61.3 159.82 11.71 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 119.437 1.618 . . . . 0.0 111.849 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 167.94 147.46 5.33 Favored Glycine 0 N--CA 1.449 -0.491 0 N-CA-C 110.005 -1.238 . . . . 0.0 110.005 179.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.0 t -167.5 166.96 14.0 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 170.27 71.42 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 106.967 -2.453 . . . . 0.0 106.967 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 43.3 m -108.21 167.07 10.27 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.289 1.436 . . . . 0.0 109.985 -179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -174.28 -97.16 0.11 Allowed Glycine 0 C--N 1.332 0.335 0 N-CA-C 106.026 -2.83 . . . . 0.0 106.026 179.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.1 t -74.14 175.74 7.22 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 72.63 50.55 14.42 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 110.474 -1.05 . . . . 0.0 110.474 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.5 t -79.72 -172.75 3.47 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 -144.13 9.96 Favored Glycine 0 C--N 1.332 0.339 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.2 t -69.38 172.51 7.03 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.589 0.756 . . . . 0.0 110.592 179.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -83.99 -127.99 1.51 Allowed Glycine 0 CA--C 1.526 0.781 0 N-CA-C 108.759 -1.736 . . . . 0.0 108.759 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 t -75.71 86.54 2.74 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -90.74 -2.48 72.28 Favored Glycine 0 CA--C 1.532 1.12 0 O-C-N 121.762 -0.587 . . . . 0.0 111.817 179.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 1.4 t 54.27 15.85 1.07 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 127.316 2.246 . . . . 0.0 113.382 -179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.89 -60.29 6.24 Favored Glycine 0 C--N 1.338 0.679 0 N-CA-C 108.28 -1.928 . . . . 0.0 108.28 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 t 44.71 46.58 8.61 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.316 1.447 . . . . 0.0 110.78 179.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -81.53 -168.86 41.41 Favored Glycine 0 CA--C 1.528 0.878 0 C-N-CA 123.671 0.653 . . . . 0.0 111.879 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 8.6 m 89.77 -8.82 0.38 Allowed 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 129.488 3.115 . . . . 0.0 114.054 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.93 77.2 2.1 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.0 p -73.8 -57.08 4.22 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 117.755 0.777 . . . . 0.0 110.192 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.24 178.68 40.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.424 1.011 . . . . 0.0 112.261 -179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.7 t -143.04 163.6 32.37 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.319 1.847 . . . . 0.0 107.969 179.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -91.79 -22.04 32.03 Favored Glycine 0 CA--C 1.527 0.795 0 O-C-N 121.274 -0.891 . . . . 0.0 114.672 -179.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 24.4 p90 -117.58 159.59 22.65 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 124.084 0.954 . . . . 0.0 111.085 -178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -69.17 143.38 54.08 Favored 'General case' 0 C--O 1.231 0.079 0 N-CA-C 108.455 -0.942 . . . . 0.0 108.455 179.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 38.8 mt -83.75 105.7 13.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -64.29 -6.97 7.91 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.511 1.524 . . . . 0.0 113.948 -179.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.8 t -137.45 66.52 1.45 Allowed 'General case' 0 CA--C 1.535 0.401 0 O-C-N 120.248 -1.533 . . . . 0.0 109.567 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 4.6 t80 -159.56 -63.75 0.07 Allowed 'General case' 0 N--CA 1.463 0.196 0 O-C-N 121.408 -0.808 . . . . 0.0 110.761 179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.71 10.1 13.24 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 125.756 1.623 . . . . 0.0 111.391 -179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.68 -31.91 17.77 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.572 1.549 . . . . 0.0 113.771 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 82.2 mm-40 -65.4 -40.3 93.27 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 118.806 0.73 . . . . 0.0 110.193 -179.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -81.07 -35.82 31.25 Favored 'General case' 0 CA--C 1.518 -0.267 0 O-C-N 121.782 -0.574 . . . . 0.0 111.35 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.78 -45.72 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.566 0 C-N-CA 125.318 1.447 . . . . 0.0 111.233 -178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -34.8 78.13 Favored 'General case' 0 N--CA 1.454 -0.238 0 O-C-N 123.447 0.467 . . . . 0.0 110.795 -178.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 74.0 m -73.49 -44.02 58.85 Favored 'General case' 0 N--CA 1.435 -1.204 0 C-N-CA 124.544 1.138 . . . . 0.0 111.633 -179.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 7.5 p -76.36 -38.12 32.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 CA-C-N 118.929 0.786 . . . . 0.0 110.553 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.53 -30.5 71.26 Favored 'General case' 0 N--CA 1.463 0.185 0 O-C-N 120.169 -1.582 . . . . 0.0 110.745 179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -58.26 -28.67 65.14 Favored 'General case' 0 C--O 1.226 -0.16 0 C-N-CA 123.995 0.918 . . . . 0.0 109.954 178.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -75.27 -33.52 61.27 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.435 0.636 . . . . 0.0 110.654 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 92.3 mt -79.42 -34.45 41.74 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -62.46 -14.9 46.22 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.3 p30 -113.89 -1.93 13.74 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.89 0.876 . . . . 0.0 112.766 179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -79.47 150.9 31.09 Favored 'General case' 0 N--CA 1.454 -0.233 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 28.9 m -78.76 167.2 21.54 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 122.77 0.428 . . . . 0.0 110.786 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.32 -50.92 71.9 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -52.72 -28.94 24.24 Favored 'General case' 0 N--CA 1.44 -0.965 0 C-N-CA 124.896 1.278 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -80.44 -51.38 8.88 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 118.998 0.817 . . . . 0.0 111.148 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.2 mt -75.7 -53.2 8.92 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 126.38 1.872 . . . . 0.0 114.51 -177.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.0 tm? -54.32 -40.38 67.92 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 127.518 2.327 . . . . 0.0 106.414 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' 3320 ' ' GLN . . . -62.66 -35.46 79.72 Favored 'General case' 0 N--CA 1.441 -0.895 0 C-N-CA 120.05 -0.66 . . . . 0.0 112.448 179.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.38 -56.73 4.98 Favored 'General case' 0 CA--C 1.519 -0.238 0 CA-C-O 121.463 0.649 . . . . 0.0 111.501 -176.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.666 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.5 pp -63.16 -31.37 72.49 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 124.011 0.925 . . . . 0.0 110.923 179.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -77.99 -25.99 48.36 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 118.27 0.486 . . . . 0.0 109.985 179.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 76.9 59.31 3.21 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 108.367 -1.893 . . . . 0.0 108.367 -179.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 5.7 t70 -140.27 -172.65 3.47 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 126.507 1.923 . . . . 0.0 108.566 -178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . 0.436 ' HB3' ' HB1' ' A' 3314 ' ' ALA . 25.8 tt0 54.88 69.48 0.73 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 126.781 2.032 . . . . 0.0 111.119 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 . . . . . 0 C--O 1.248 0.992 0 C-N-CA 127.741 2.416 . . . . 0.0 111.727 179.379 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 ptt? . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 118.428 -0.796 . . . . 0.0 113.094 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -85.73 43.98 1.08 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.535 1.516 . . . . 0.0 111.163 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.511 HG21 ' HB2' ' A' ' 6' ' ' GLN . 3.7 tp -165.34 172.52 0.2 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.384 0 C-N-CA 124.709 1.203 . . . . 0.0 109.875 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -140.8 -51.38 0.46 Allowed 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 125.689 1.596 . . . . 0.0 108.652 178.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -58.75 -43.91 90.43 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.872 1.215 . . . . 0.0 110.783 179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.511 ' HB2' HG21 ' A' ' 3' ' ' ILE . 23.3 mt-30 -70.09 -27.4 64.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.371 179.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.8 m -70.34 -33.98 72.11 Favored 'General case' 0 C--O 1.224 -0.246 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.674 178.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.43 ' HA ' HD23 ' A' ' 11' ' ' LEU . 13.3 mt -52.7 -28.39 21.62 Favored 'General case' 0 C--O 1.22 -0.48 0 C-N-CA 126.392 1.877 . . . . 0.0 108.561 -179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -51.99 -46.36 64.86 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.059 1.344 . . . . 0.0 110.096 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 ptmt -67.78 -28.82 67.93 Favored 'General case' 0 C--N 1.346 0.42 0 O-C-N 122.187 -0.321 . . . . 0.0 110.204 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.1 mm? -76.25 -55.17 5.82 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 121.427 -0.796 . . . . 0.0 110.471 179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.18 -39.53 82.85 Favored 'General case' 0 CA--C 1.51 -0.589 0 O-C-N 120.264 -1.523 . . . . 0.0 112.611 -178.017 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -58.4 -31.9 68.11 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.26 0.482 . . . . 0.0 110.684 178.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.458 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.25 -49.23 24.14 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 121.336 -0.853 . . . . 0.0 109.821 179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.6 t -59.68 -42.07 87.32 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.151 0 C-N-CA 123.101 0.56 . . . . 0.0 109.754 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.4 -45.4 84.11 Favored 'General case' 0 CA--C 1.518 -0.25 0 CA-C-O 118.681 -0.676 . . . . 0.0 109.361 -179.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -61.1 -49.21 78.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 118.541 -0.743 . . . . 0.0 109.965 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -64.83 -37.63 88.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 120.844 1.656 . . . . 0.0 110.997 178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 38.4 mttp -57.06 -28.54 62.65 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 118.142 -0.932 . . . . 0.0 111.728 179.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 10.0 mm -62.41 -41.55 92.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 120.786 1.63 . . . . 0.0 108.532 179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 38.5 mttm -65.51 -29.04 69.63 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.168 1.387 . . . . 0.0 109.872 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -73.35 -50.44 21.96 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 118.079 -0.963 . . . . 0.0 109.893 -178.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.15 -40.06 95.33 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 119.345 0.975 . . . . 0.0 111.447 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -68.44 -45.25 82.46 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.252 0.933 . . . . 0.0 111.507 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 46.3 tt0 -76.27 -48.13 21.3 Favored 'General case' 0 N--CA 1.453 -0.288 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -177.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 17.5 m-80 -73.13 -51.15 19.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 -178.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t 56.19 17.75 2.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.822 1.249 . . . . 0.0 113.055 -179.15 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -128.25 -176.11 3.71 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 125.901 1.681 . . . . 0.0 110.857 -179.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 70.3 m -128.96 -43.19 1.35 Allowed 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 116.012 1.856 . . . . 0.0 116.012 -178.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -148.5 23.22 1.02 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.992 0.901 . . . . 0.0 109.514 -178.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 60.19 39.25 19.52 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.223 1.009 . . . . 0.0 110.884 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -32.68 73.87 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.03 0.932 . . . . 0.0 113.36 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER 172.42 163.33 0.11 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 128.926 2.89 . . . . 0.0 110.27 178.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 126.83 2.64 Favored Glycine 0 CA--C 1.522 0.479 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 91.3 p -147.13 -167.21 2.71 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.192 1.397 . . . . 0.0 109.047 179.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -170.21 176.95 43.74 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 107.444 -2.262 . . . . 0.0 107.444 179.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.9 t -144.99 178.08 8.29 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 117.919 0.859 . . . . 0.0 109.878 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -90.55 -155.35 31.24 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 125.503 1.525 . . . . 0.0 111.167 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.6 p -142.59 -172.8 3.71 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 125.098 1.359 . . . . 0.0 109.741 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -130.86 -177.45 14.9 Favored Glycine 0 C--N 1.334 0.47 0 C-N-CA 125.764 1.649 . . . . 0.0 109.564 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.3 m -49.49 -53.39 23.47 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.186 1.394 . . . . 0.0 112.345 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 129.77 162.33 10.79 Favored Glycine 0 CA--C 1.524 0.621 0 C-N-CA 125.267 1.413 . . . . 0.0 110.52 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -175.93 137.32 0.33 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 128.59 2.756 . . . . 0.0 104.91 179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -145.15 -171.09 14.58 Favored Glycine 0 CA--C 1.524 0.643 0 C-N-CA 124.363 0.982 . . . . 0.0 111.391 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 59.0 p -140.45 -93.99 0.15 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.454 1.102 . . . . 0.0 108.523 179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 179.66 151.51 9.92 Favored Glycine 0 CA--C 1.523 0.554 0 N-CA-C 107.917 -2.073 . . . . 0.0 107.917 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.9 t -169.68 -33.25 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.648 1.179 . . . . 0.0 109.742 -179.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 42.5 46.09 5.6 Favored Glycine 0 C--N 1.342 0.892 0 C-N-CA 127.167 2.317 . . . . 0.0 114.204 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.0 t -83.06 -7.16 59.68 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 115.104 1.52 . . . . 0.0 115.104 -178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -175.66 -89.61 0.08 OUTLIER Glycine 0 C--N 1.337 0.636 0 CA-C-N 121.058 1.754 . . . . 0.0 113.814 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 2.5 m 52.72 26.3 4.37 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.618 1.167 . . . . 0.0 112.252 -179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -65.23 154.31 50.16 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 124.334 0.968 . . . . 0.0 113.839 -178.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.6 m -73.9 177.41 5.6 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.405 1.082 . . . . 0.0 109.419 178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.71 179.86 24.05 Favored Glycine 0 C--O 1.237 0.334 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 179.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 11.9 p -129.08 155.25 45.74 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.326 1.85 . . . . 0.0 108.03 179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 58.16 -111.3 3.01 Favored Glycine 0 CA--C 1.52 0.344 0 C-N-CA 124.332 0.968 . . . . 0.0 111.442 -179.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 3.6 p -133.77 -27.23 1.5 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 126.514 1.926 . . . . 0.0 112.839 -178.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 64.72 -132.64 37.63 Favored Glycine 0 CA--C 1.526 0.736 0 CA-C-N 119.301 0.955 . . . . 0.0 111.345 179.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -87.35 -170.03 2.86 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.111 1.365 . . . . 0.0 108.936 179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -60.85 158.93 12.06 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 121.628 -0.67 . . . . 0.0 110.37 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 47.5 mt -88.86 105.48 15.86 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.506 0 N-CA-C 102.26 -3.237 . . . . 0.0 102.26 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -61.78 -23.08 65.97 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 114.062 1.134 . . . . 0.0 114.062 -178.178 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 14.9 t -129.89 70.62 1.43 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.996 1.271 . . . . 0.0 112.525 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 38.6 t80 -159.21 -30.08 0.07 Allowed 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.225 -0.922 . . . . 0.0 113.415 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -146.77 14.27 1.19 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.823 1.249 . . . . 0.0 110.799 179.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.46 -35.05 27.13 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.115 1.766 . . . . 0.0 112.25 -178.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . 0.551 ' H ' ' CD ' ' A' 3295 ' ' GLN . 25.6 mp0 -57.64 -49.5 76.26 Favored 'General case' 0 N--CA 1.444 -0.75 0 C-N-CA 128.027 2.531 . . . . 0.0 109.76 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -79.55 -37.3 36.81 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.33 -1.305 . . . . 0.0 110.906 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -53.72 -45.78 61.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 C-N-CA 125.894 1.678 . . . . 0.0 110.111 -178.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.2 -35.76 80.3 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 -179.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 58.9 m -72.01 -34.66 69.02 Favored 'General case' 0 N--CA 1.445 -0.684 0 O-C-N 121.207 -0.933 . . . . 0.0 111.411 -178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 42.1 t -71.14 -50.21 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 178.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -31.91 72.91 Favored 'General case' 0 N--CA 1.461 0.082 0 CA-C-O 117.687 -1.149 . . . . 0.0 111.4 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 12.4 mtpt -58.93 -28.68 66.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.245 1.018 . . . . 0.0 109.945 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -73.49 -47.22 42.9 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 122.794 1.283 . . . . 0.0 108.84 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 82.9 mt -68.48 -33.41 74.11 Favored 'General case' 0 N--CA 1.447 -0.623 0 N-CA-C 116.252 1.945 . . . . 0.0 116.252 -177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -64.37 -14.22 55.24 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 118.49 -0.767 . . . . 0.0 112.505 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.1 p30 -114.12 6.76 16.46 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 124.003 0.921 . . . . 0.0 111.941 178.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -93.83 157.77 15.98 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.217 0.462 . . . . 0.0 110.358 178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 52.1 m -86.23 169.32 13.14 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 126.38 1.872 . . . . 0.0 110.888 179.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -58.75 -52.04 67.42 Favored 'General case' 0 C--O 1.206 -1.196 0 CA-C-O 117.179 -1.391 . . . . 0.0 108.138 179.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -52.59 -28.68 22.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 119.798 1.181 . . . . 0.0 112.441 -177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -79.69 -50.81 10.06 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-O 121.589 0.709 . . . . 0.0 110.295 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.8 mt -75.75 -53.12 9.02 Favored 'General case' 0 CA--C 1.523 -0.08 0 C-N-CA 124.142 0.977 . . . . 0.0 113.371 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.1 tm? -54.39 -40.69 68.43 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 128.478 2.711 . . . . 0.0 106.803 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.47 -27.8 68.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 119.464 -0.894 . . . . 0.0 112.131 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 1.4 mmt -76.94 -55.6 5.32 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 120.456 -1.403 . . . . 0.0 111.178 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.458 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.1 pp -60.33 -40.02 89.17 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 117.32 -1.324 . . . . 0.0 111.134 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -82.25 -26.2 33.43 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 124.912 1.382 . . . . 0.0 112.897 -178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 75.64 63.82 2.38 Favored Glycine 0 CA--C 1.525 0.689 0 N-CA-C 106.764 -2.535 . . . . 0.0 106.764 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 6.5 t70 -138.63 -172.01 3.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 126.072 1.749 . . . . 0.0 110.575 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.41 70.06 1.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.451 1.9 . . . . 0.0 109.88 -179.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 63.2 mm-40 . . . . . 0 C--O 1.249 1.027 0 O-C-N 121.74 -0.6 . . . . 0.0 110.099 179.667 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.5 mtm . . . . . 0 N--CA 1.47 0.551 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 67.4 m-80 -86.23 69.61 10.48 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.121 0.969 . . . . 0.0 110.668 -179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.454 HG13 ' H ' ' A' ' 6' ' ' GLN . 7.0 tp -173.2 162.31 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.483 0 C-N-CA 127.667 2.387 . . . . 0.0 108.839 -179.642 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.1 p-10 -122.22 -54.38 1.9 Allowed 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 129.754 3.222 . . . . 0.0 110.401 -179.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -58.41 -37.6 75.67 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 119.97 1.259 . . . . 0.0 112.598 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.454 ' H ' HG13 ' A' ' 3' ' ' ILE . 72.0 mt-30 -75.33 -27.3 59.2 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 179.026 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.5 m -72.75 -31.8 65.19 Favored 'General case' 0 C--N 1.339 0.133 0 O-C-N 120.803 -1.186 . . . . 0.0 111.517 178.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.422 ' HA ' HD23 ' A' ' 11' ' ' LEU . 18.0 mt -53.11 -29.53 31.31 Favored 'General case' 0 C--O 1.215 -0.716 0 C-N-CA 125.663 1.585 . . . . 0.0 107.612 -179.2 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -52.02 -45.22 64.49 Favored 'General case' 0 C--N 1.337 0.06 0 CA-C-N 119.567 1.076 . . . . 0.0 110.23 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.3 ptmt -66.79 -28.57 68.49 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.634 1.106 . . . . 0.0 110.314 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.482 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -76.23 -55.18 5.8 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.992 0.917 . . . . 0.0 110.645 179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 9.5 ptt85 -60.19 -41.29 92.63 Favored 'General case' 0 CA--C 1.51 -0.567 0 O-C-N 120.079 -1.638 . . . . 0.0 111.197 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.4 pp0? -60.52 -32.19 71.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.893 0.77 . . . . 0.0 110.269 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.82 -48.97 33.33 Favored 'General case' 0 C--O 1.234 0.289 0 O-C-N 121.581 -0.699 . . . . 0.0 109.194 179.52 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 43.9 t -61.65 -44.68 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 CA-C-O 121.682 0.754 . . . . 0.0 109.38 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.57 -38.37 89.83 Favored 'General case' 0 N--CA 1.456 -0.164 0 O-C-N 120.85 -1.156 . . . . 0.0 110.894 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -61.74 -49.52 76.06 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.76 0.709 . . . . 0.0 111.164 179.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -33.5 71.06 Favored 'General case' 0 N--CA 1.461 0.088 0 O-C-N 120.773 -1.205 . . . . 0.0 110.342 179.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -55.1 -32.96 62.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 118.138 -0.934 . . . . 0.0 110.219 178.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.422 HD12 HD11 ' A' 3297 ' ' ILE . 13.5 mm -55.71 -44.8 78.41 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.411 1.005 . . . . 0.0 110.224 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.1 mttt -68.01 -31.69 71.56 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.643 0.777 . . . . 0.0 110.731 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.98 -49.79 27.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -178.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.37 -35.54 81.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 tt -75.21 -43.41 44.0 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 CA-C-N 118.846 0.748 . . . . 0.0 110.735 179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -76.45 -48.44 19.64 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 114.142 1.164 . . . . 0.0 114.142 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -73.11 -51.19 18.92 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 56.01 26.11 9.59 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.63 0.772 . . . . 0.0 112.907 179.385 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD22 ' HA ' ' A' ' 31' ' ' GLU . 3.1 pp -139.23 -169.47 2.67 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.565 1.146 . . . . 0.0 113.102 -177.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 73.3 m -131.61 -28.92 1.79 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 116.154 1.909 . . . . 0.0 116.154 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.5 t -156.98 19.99 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.97 0.805 . . . . 0.0 110.461 -177.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.581 ' HA ' HD22 ' A' ' 28' ' ' LEU . 20.7 mt-10 66.87 32.39 6.63 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.727 0.811 . . . . 0.0 109.018 -178.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.52 156.95 18.27 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -102.21 151.47 22.17 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 53.92 -152.75 9.8 Favored Glycine 0 CA--C 1.53 0.997 0 C-N-CA 124.411 1.005 . . . . 0.0 112.248 -179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.9 m -79.7 156.45 27.55 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.83 1.252 . . . . 0.0 108.424 178.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -177.77 171.04 43.6 Favored Glycine 0 C--N 1.334 0.469 0 O-C-N 120.626 -1.296 . . . . 0.0 112.453 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 45.2 m -70.66 157.66 37.59 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.601 1.56 . . . . 0.0 111.433 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -59.57 -164.69 0.14 Allowed Glycine 0 CA--C 1.531 1.041 0 C-N-CA 129.191 3.281 . . . . 0.0 117.57 -178.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.5 p -149.82 -172.27 4.11 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.336 1.855 . . . . 0.0 110.528 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -128.52 174.13 19.0 Favored Glycine 0 CA--C 1.533 1.179 0 C-N-CA 124.573 1.082 . . . . 0.0 113.061 -179.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.4 m -128.33 -175.39 3.49 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.181 1.393 . . . . 0.0 111.737 -179.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -105.1 -170.24 24.11 Favored Glycine 0 CA--C 1.524 0.6 0 C-N-CA 125.615 1.579 . . . . 0.0 112.474 -178.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -164.43 174.15 11.32 Favored 'General case' 0 C--O 1.239 0.539 0 C-N-CA 126.434 1.893 . . . . 0.0 108.387 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.32 -167.19 14.97 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 128.69 3.043 . . . . 0.0 109.923 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 58.2 m -155.22 167.05 31.65 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 127.127 2.171 . . . . 0.0 108.506 179.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.74 175.18 43.84 Favored Glycine 0 CA--C 1.525 0.663 0 O-C-N 121.464 -0.773 . . . . 0.0 111.514 179.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.3 p -163.54 162.34 24.44 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 125.073 1.349 . . . . 0.0 110.05 179.296 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 143.04 151.55 5.5 Favored Glycine 0 CA--C 1.521 0.466 0 N-CA-C 111.404 -0.678 . . . . 0.0 111.404 179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 27.5 m -139.4 160.05 40.73 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.611 1.164 . . . . 0.0 108.065 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 148.04 -160.75 28.43 Favored Glycine 0 CA--C 1.523 0.57 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 3.8 p -109.51 112.13 24.04 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.974 0.909 . . . . 0.0 111.298 -179.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.86 -65.3 0.12 Allowed Glycine 0 C--N 1.332 0.354 0 N-CA-C 107.711 -2.156 . . . . 0.0 107.711 179.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 m 50.15 68.83 0.69 Allowed 'General case' 0 C--O 1.237 0.435 0 C-N-CA 126.399 1.879 . . . . 0.0 110.909 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.37 167.62 19.26 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 123.953 0.787 . . . . 0.0 113.238 -179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 42.6 t -138.18 177.05 8.17 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 127.459 2.303 . . . . 0.0 107.93 -179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -127.03 -129.0 3.2 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 106.361 -2.696 . . . . 0.0 106.361 179.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 36.7 p -159.56 170.55 21.4 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 119.375 1.588 . . . . 0.0 110.771 178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -132.0 88.08 0.28 Allowed Glycine 0 C--N 1.335 0.515 0 C-N-CA 126.398 1.951 . . . . 0.0 109.344 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.3 m-85 -127.08 -11.86 5.85 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.378 1.089 . . . . 0.0 113.68 -179.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -86.31 -175.27 5.43 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.717 1.207 . . . . 0.0 111.395 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -84.64 98.91 6.36 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 -179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -72.86 -6.74 47.01 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.628 1.171 . . . . 0.0 111.023 179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 15.0 t -124.61 48.41 1.97 Allowed 'General case' 0 CA--C 1.532 0.273 0 O-C-N 120.793 -1.192 . . . . 0.0 111.794 -179.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 31.1 t80 -152.28 -72.34 0.15 Allowed 'General case' 0 CA--C 1.523 -0.083 0 O-C-N 120.751 -1.218 . . . . 0.0 109.604 179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -102.65 9.69 39.13 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 124.286 1.035 . . . . 0.0 113.25 -178.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.29 -31.23 13.77 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.344 1.058 . . . . 0.0 113.625 -178.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 97.6 mm-40 -65.94 -47.13 75.68 Favored 'General case' 0 C--O 1.223 -0.312 0 C-N-CA 124.36 1.064 . . . . 0.0 110.658 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -80.05 -26.72 39.6 Favored 'General case' 0 N--CA 1.467 0.4 0 O-C-N 121.304 -0.872 . . . . 0.0 110.318 178.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.422 HD11 HD12 ' A' ' 20' ' ' ILE . 0.9 OUTLIER -60.79 -47.29 93.87 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.09 0 C-N-CA 125.658 1.583 . . . . 0.0 108.687 179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.97 -35.25 79.55 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 118.166 0.439 . . . . 0.0 110.433 -179.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 19.7 t -71.66 -44.9 63.47 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 125.588 1.555 . . . . 0.0 110.933 -178.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 8.0 p -76.03 -40.38 37.6 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 O-C-N 121.22 -0.925 . . . . 0.0 110.708 -179.612 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.414 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -65.05 -31.01 72.01 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.046 -0.978 . . . . 0.0 110.362 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 15.5 mtpp -56.39 -32.77 65.11 Favored 'General case' 0 C--N 1.34 0.157 0 C-N-CA 123.795 0.838 . . . . 0.0 109.249 178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -72.03 -46.31 57.58 Favored 'General case' 0 CA--C 1.532 0.263 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 179.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.1 mt -63.63 -35.86 81.92 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.7 pt-20 -69.68 -10.93 60.22 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.7 p30 -111.65 -2.04 15.52 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.72 156.07 23.97 Favored 'General case' 0 C--N 1.342 0.278 0 CA-C-N 118.607 0.64 . . . . 0.0 109.36 178.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 31.0 m -86.08 168.39 14.11 Favored 'General case' 0 CA--C 1.528 0.108 0 C-N-CA 123.743 0.817 . . . . 0.0 110.241 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' 3313 ' ' LEU . 1.1 mt-10 -56.38 -51.3 68.84 Favored 'General case' 0 C--O 1.205 -1.274 0 CA-C-O 116.786 -1.578 . . . . 0.0 107.876 179.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -52.53 -27.81 18.03 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 121.288 1.858 . . . . 0.0 112.541 -177.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -80.48 -51.7 8.49 Favored 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 121.269 -0.894 . . . . 0.0 110.989 178.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.8 mt -76.43 -53.4 8.19 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.937 1.695 . . . . 0.0 114.06 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.451 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.9 tm? -54.4 -41.75 69.64 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 127.948 2.499 . . . . 0.0 106.088 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.86 -26.64 67.73 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.796 0.725 . . . . 0.0 112.851 -179.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -76.98 -56.05 4.93 Favored 'General case' 0 CA--C 1.515 -0.382 0 O-C-N 120.953 -1.092 . . . . 0.0 110.079 -178.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.482 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.13 -35.74 79.67 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 123.408 0.683 . . . . 0.0 110.501 178.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -78.68 -19.79 51.67 Favored 'General case' 0 C--O 1.231 0.084 0 C-N-CA 122.513 0.325 . . . . 0.0 111.014 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 61.72 52.75 48.62 Favored Glycine 0 C--N 1.334 0.457 0 N-CA-C 106.706 -2.558 . . . . 0.0 106.706 -179.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.1 t0 -126.6 161.59 27.68 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 125.786 1.634 . . . . 0.0 111.063 -178.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -145.69 30.84 1.08 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.403 1.481 . . . . 0.0 111.09 -178.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 2.6 pt20 . . . . . 0 C--O 1.255 1.35 0 C-N-CA 123.973 0.909 . . . . 0.0 111.131 -178.825 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -77.48 -153.93 0.06 Allowed 'General case' 0 C--O 1.237 0.414 0 N-CA-C 104.971 -2.233 . . . . 0.0 104.971 177.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 7.7 tp -72.8 166.0 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 177.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -141.08 -40.17 0.4 Allowed 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.245 0.618 . . . . 0.0 110.208 -179.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -64.81 -36.34 84.0 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.211 1.004 . . . . 0.0 109.373 178.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -77.41 -27.77 52.47 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.2 m -66.08 -32.6 74.15 Favored 'General case' 0 C--N 1.338 0.089 0 CA-C-O 117.095 -1.431 . . . . 0.0 109.503 178.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.488 ' HA ' HD23 ' A' ' 11' ' ' LEU . 43.7 mt -52.42 -29.08 22.59 Favored 'General case' 0 C--O 1.217 -0.643 0 C-N-CA 126.088 1.755 . . . . 0.0 107.688 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -51.79 -43.36 63.02 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.635 1.107 . . . . 0.0 110.715 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.435 ' HG2' HD22 ' A' ' 11' ' ' LEU . 19.2 ptmt -68.99 -28.71 66.85 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.294 -0.879 . . . . 0.0 110.321 179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.536 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.84 -54.62 6.63 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.491 1.117 . . . . 0.0 110.466 -179.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -58.96 -41.07 86.6 Favored 'General case' 0 CA--C 1.511 -0.526 0 O-C-N 120.234 -1.541 . . . . 0.0 111.849 -178.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.22 -31.61 72.17 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 118.812 0.733 . . . . 0.0 110.091 179.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.467 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -73.67 -45.83 50.18 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.427 -0.796 . . . . 0.0 108.975 178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.52 HG23 HD23 ' A' 3316 ' ' LEU . 57.0 t -64.85 -41.89 93.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 O-C-N 121.628 -0.67 . . . . 0.0 110.516 179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pp -63.21 -36.72 84.57 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.328 -0.858 . . . . 0.0 109.926 179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -63.02 -49.77 73.32 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 118.287 -0.863 . . . . 0.0 112.288 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.49 -37.52 87.6 Favored 'General case' 0 C--N 1.345 0.389 0 CA-C-N 121.107 1.776 . . . . 0.0 109.133 178.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.4 mttm -54.88 -32.49 60.94 Favored 'General case' 0 CA--C 1.521 -0.172 0 CA-C-O 117.593 -1.194 . . . . 0.0 111.144 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.426 ' O ' HG22 ' A' ' 24' ' ' ILE . 16.7 mm -59.82 -46.21 93.97 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 CA-C-N 120.34 1.427 . . . . 0.0 109.009 178.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -68.75 -28.36 66.73 Favored 'General case' 0 C--N 1.331 -0.198 0 C-N-CA 125.336 1.454 . . . . 0.0 110.541 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -75.66 -49.85 17.17 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.31 -0.852 . . . . 0.0 110.433 -178.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.64 -34.57 78.13 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 119.338 0.972 . . . . 0.0 112.911 -179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.426 HG22 ' O ' ' A' ' 20' ' ' ILE . 4.8 tt -73.59 -43.27 55.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 118.994 0.816 . . . . 0.0 111.066 179.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.5 tt0 -76.32 -47.8 22.29 Favored 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 -78.02 -51.63 10.04 Favored 'General case' 0 C--N 1.333 -0.144 0 C-N-CA 123.511 0.724 . . . . 0.0 112.181 -178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 50.01 30.18 3.92 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 126.105 1.762 . . . . 0.0 112.871 -178.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.7 pp -136.08 -177.32 4.64 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 125.738 1.615 . . . . 0.0 111.509 -178.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 71.0 m -135.16 -40.25 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 128.907 2.883 . . . . 0.0 112.426 -179.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.2 t -147.99 14.81 1.04 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.113 1.365 . . . . 0.0 110.171 -179.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 69.59 47.76 0.64 Allowed 'General case' 0 CA--C 1.541 0.62 0 O-C-N 120.591 -1.318 . . . . 0.0 109.127 -179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.8 163.33 28.28 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.662 1.585 . . . . 0.0 107.318 177.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -140.33 156.43 46.44 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.099 -1.001 . . . . 0.0 110.198 179.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 131.06 81.66 0.23 Allowed Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.3 t -126.93 155.85 42.43 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.907 1.283 . . . . 0.0 109.566 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.18 156.51 32.33 Favored Glycine 0 CA--C 1.525 0.682 0 C-N-CA 125.763 1.649 . . . . 0.0 110.446 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.1 t -155.82 -49.76 0.08 Allowed 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 179.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.21 -171.96 38.67 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.123 -1.191 . . . . 0.0 110.123 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.4 m 60.18 -10.62 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 116.675 2.102 . . . . 0.0 116.675 179.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -82.09 61.34 4.7 Favored Glycine 0 CA--C 1.527 0.786 0 N-CA-C 109.599 -1.4 . . . . 0.0 109.599 179.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.4 m -56.57 -10.76 1.06 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.45 2.3 . . . . 0.0 115.482 -178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -67.42 -23.38 73.48 Favored Glycine 0 CA--C 1.534 1.221 0 CA-C-N 119.577 1.08 . . . . 0.0 111.861 179.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.5 t 56.91 5.7 0.25 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.146 1.778 . . . . 0.0 114.81 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -94.88 -100.0 1.72 Allowed Glycine 0 C--N 1.337 0.585 0 CA-C-N 120.691 1.587 . . . . 0.0 109.737 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.3 t 56.39 14.87 1.76 Allowed 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 179.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -47.18 111.87 0.84 Allowed Glycine 0 C--N 1.339 0.707 0 C-N-CA 125.357 1.456 . . . . 0.0 112.123 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -127.64 156.54 42.15 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.069 1.347 . . . . 0.0 108.884 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 162.39 -115.03 0.63 Allowed Glycine 0 CA--C 1.521 0.449 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.3 m 65.37 85.48 0.14 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.253 1.821 . . . . 0.0 111.353 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.21 158.76 25.45 Favored Glycine 0 CA--C 1.526 0.781 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 179.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.6 m -159.61 166.1 31.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.347 1.459 . . . . 0.0 110.211 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -160.19 -140.46 2.9 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 110.098 -1.201 . . . . 0.0 110.098 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -119.25 -19.1 8.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.376 1.088 . . . . 0.0 111.86 179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -175.07 166.42 38.03 Favored Glycine 0 C--N 1.337 0.586 0 CA-C-N 119.987 1.267 . . . . 0.0 111.397 179.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.1 m -128.43 157.66 40.46 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.38 1.072 . . . . 0.0 109.547 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.567 ' H ' ' CG2' ' A' 3297 ' ' ILE . . . -54.19 148.74 18.95 Favored Glycine 0 CA--C 1.527 0.789 0 C-N-CA 125.074 1.321 . . . . 0.0 111.611 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.3 m -93.49 175.13 6.86 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 126.018 1.727 . . . . 0.0 113.684 -178.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 82.22 -171.1 51.61 Favored Glycine 0 CA--C 1.526 0.759 0 O-C-N 121.316 -0.865 . . . . 0.0 113.579 179.204 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -65.75 30.32 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 128.086 2.554 . . . . 0.0 115.08 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -82.25 174.82 10.8 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 120.147 -1.596 . . . . 0.0 107.794 177.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 22.1 mt -101.36 94.86 3.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 124.147 0.979 . . . . 0.0 108.95 -178.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -65.37 -7.46 13.84 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 127.527 2.331 . . . . 0.0 114.269 -179.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.261 3.6 t -127.05 31.16 5.31 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.491 1.116 . . . . 0.0 112.314 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 20.6 t80 -141.59 -39.76 0.38 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 123.264 0.625 . . . . 0.0 112.18 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.95 8.35 3.24 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 118.845 0.748 . . . . 0.0 112.415 179.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -54.07 -33.02 56.44 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 119.667 1.122 . . . . 0.0 111.348 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -58.2 -42.33 85.94 Favored 'General case' 0 C--O 1.223 -0.328 0 C-N-CA 124.159 0.983 . . . . 0.0 110.3 179.631 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -81.35 -41.8 21.48 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 123.002 1.382 . . . . 0.0 110.345 177.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.567 ' CG2' ' H ' ' A' ' 56' ' ' GLY . 1.1 mp -53.23 -42.99 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 CA-C-O 117.62 -1.181 . . . . 0.0 111.95 -177.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -62.6 -37.72 87.35 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.427 1.491 . . . . 0.0 109.928 -179.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 25.8 t -70.69 -46.06 63.86 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.962 1.705 . . . . 0.0 109.515 -179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 66.9 t -67.2 -51.26 55.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 C-N-CA 123.597 0.759 . . . . 0.0 109.309 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.2 -30.87 71.94 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.61 -1.306 . . . . 0.0 111.416 -178.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.9 mtpt -58.4 -27.82 64.63 Favored 'General case' 0 C--N 1.34 0.184 0 C-N-CA 124.123 0.969 . . . . 0.0 110.263 177.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -77.24 -41.55 40.73 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.332 0.587 . . . . 0.0 110.005 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.09 -34.86 77.2 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 114.568 1.322 . . . . 0.0 114.568 -177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -63.62 -13.69 44.64 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 123.935 0.894 . . . . 0.0 112.725 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.4 p30 -115.35 -5.4 12.32 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.411 1.084 . . . . 0.0 111.795 177.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.33 154.85 27.53 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 119.659 1.118 . . . . 0.0 110.805 -179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 54.6 m -83.05 173.39 11.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.925 2.09 . . . . 0.0 111.472 179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.21 -49.89 70.22 Favored 'General case' 0 C--O 1.21 -0.998 0 CA-C-N 119.715 1.143 . . . . 0.0 108.785 -179.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -52.04 -28.01 15.74 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 123.916 0.886 . . . . 0.0 111.038 -178.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -80.7 -52.17 7.85 Favored 'General case' 0 N--CA 1.438 -1.072 0 O-C-N 121.774 -0.579 . . . . 0.0 111.192 177.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -77.14 -53.9 7.19 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.498 1.519 . . . . 0.0 115.034 -178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.02 -40.93 67.46 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 127.811 2.445 . . . . 0.0 106.408 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.9 -27.54 68.27 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.4 0.889 . . . . 0.0 113.4 -179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 2.1 mmm -77.68 -54.72 6.04 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.075 -1.016 . . . . 0.0 109.784 -178.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.536 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -64.38 -33.66 76.36 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 119.146 -0.454 . . . . 0.0 110.339 179.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -81.95 -21.23 37.34 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-N 118.523 0.602 . . . . 0.0 110.16 179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 57.76 51.2 59.47 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 108.419 -1.873 . . . . 0.0 108.419 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 7.6 p30 -90.29 -168.19 2.04 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 125.227 1.411 . . . . 0.0 111.861 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -128.29 24.64 5.88 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 127.321 2.249 . . . . 0.0 113.13 -178.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 12.2 mt-30 . . . . . 0 C--O 1.253 1.239 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.574 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -133.99 38.3 3.19 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 122.221 2.282 . . . . 0.0 112.433 -177.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.415 HG12 ' H ' ' A' ' 6' ' ' GLN . 7.9 tt -163.78 162.86 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 O-C-N 121.579 -0.701 . . . . 0.0 111.1 -179.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -114.91 -47.79 2.86 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-O 116.912 -1.518 . . . . 0.0 110.403 178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -58.41 -43.04 88.49 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 120.404 1.456 . . . . 0.0 111.732 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.415 ' H ' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -76.16 -25.92 55.75 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.838 -0.539 . . . . 0.0 109.793 178.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.2 m -71.17 -29.41 65.17 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 120.226 -1.547 . . . . 0.0 109.452 177.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.2 mt -53.28 -30.66 39.81 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 120.189 1.359 . . . . 0.0 107.554 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -52.09 -49.04 64.35 Favored 'General case' 0 N--CA 1.463 0.182 0 C-N-CA 125.332 1.453 . . . . 0.0 109.263 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.13 -28.66 68.97 Favored 'General case' 0 C--N 1.346 0.414 0 CA-C-N 118.701 0.682 . . . . 0.0 111.315 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.524 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.97 -55.1 5.92 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.028 0.531 . . . . 0.0 110.406 178.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 19.8 ptt85 -58.01 -42.53 85.45 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 119.864 -1.773 . . . . 0.0 111.279 -178.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 3.0 pp0? -60.96 -30.63 70.36 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 122.851 0.46 . . . . 0.0 110.875 179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -74.14 -48.22 30.84 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.043 -1.035 . . . . 0.0 108.812 178.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.45 -52.59 59.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.407 ' HB3' HD12 ' A' 3304 ' ' LEU . 0.9 OUTLIER -55.52 -34.64 64.84 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.46 1.104 . . . . 0.0 113.081 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -58.76 -48.65 80.48 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 119.052 0.842 . . . . 0.0 110.416 179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.06 -31.91 69.75 Favored 'General case' 0 C--N 1.34 0.169 0 C-N-CA 119.092 -1.043 . . . . 0.0 111.054 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 48.8 mttt -55.0 -32.14 61.54 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-O 118.262 -0.875 . . . . 0.0 110.386 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.1 mm -62.98 -37.73 80.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 CA-C-N 119.947 1.249 . . . . 0.0 109.419 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.437 ' HA ' HG22 ' A' ' 24' ' ' ILE . 36.5 mtmt -72.59 -29.4 63.49 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 125.499 1.52 . . . . 0.0 110.427 179.041 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 98.1 mt-10 -74.06 -49.91 22.0 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.231 -0.918 . . . . 0.0 108.655 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -30.75 71.67 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-O 118.418 -0.801 . . . . 0.0 111.88 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.437 HG22 ' HA ' ' A' ' 21' ' ' LYS . 2.3 tt -76.91 -43.51 32.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 120.143 1.338 . . . . 0.0 109.784 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -75.93 -49.01 18.98 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.4 m-80 -78.58 -51.95 9.18 Favored 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 50.84 23.64 1.5 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.487 1.515 . . . . 0.0 112.632 -178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -134.57 -174.45 3.58 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 127.473 2.309 . . . . 0.0 111.273 -178.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 m -128.93 -40.51 1.51 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 126.093 1.757 . . . . 0.0 110.788 178.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 14.9 t -153.85 34.01 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.425 0.69 . . . . 0.0 110.016 -178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 58.97 31.57 21.47 Favored 'General case' 0 N--CA 1.473 0.698 0 O-C-N 121.25 -0.906 . . . . 0.0 112.102 178.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.48 141.87 11.52 Favored 'General case' 0 C--N 1.34 0.188 0 C-N-CA 124.944 1.298 . . . . 0.0 113.357 -178.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 53.5 m-85 -58.32 -42.77 87.51 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 178.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 77.0 -155.02 43.93 Favored Glycine 0 CA--C 1.526 0.773 0 N-CA-C 109.16 -1.576 . . . . 0.0 109.16 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 50.6 p -151.16 -171.52 3.96 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 124.562 1.145 . . . . 0.0 109.712 -179.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -153.77 -174.17 23.68 Favored Glycine 0 CA--C 1.527 0.794 0 C-N-CA 126.201 1.858 . . . . 0.0 108.907 179.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 7.4 t -141.75 -169.85 2.99 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.613 1.165 . . . . 0.0 109.062 179.334 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 138.26 -1.87 2.8 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 126.821 2.153 . . . . 0.0 111.38 -179.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.8 p -144.21 -168.25 2.83 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.557 1.943 . . . . 0.0 107.82 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -76.69 -167.51 26.48 Favored Glycine 0 CA--C 1.532 1.128 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 2.9 p 51.17 75.87 0.18 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.7 1.6 . . . . 0.0 113.228 179.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -75.68 160.12 51.59 Favored Glycine 0 CA--C 1.529 0.935 0 N-CA-C 108.725 -1.75 . . . . 0.0 108.725 178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.3 m -149.47 150.39 32.27 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.812 0.845 . . . . 0.0 109.768 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.05 13.37 Favored Glycine 0 CA--C 1.524 0.607 0 C-N-CA 124.759 1.171 . . . . 0.0 110.967 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.4 m -152.71 161.79 42.11 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 126.776 2.03 . . . . 0.0 107.848 179.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -162.66 162.01 34.17 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 108.851 -1.7 . . . . 0.0 108.851 179.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.3 t -157.96 150.72 22.7 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.409 1.084 . . . . 0.0 109.211 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 173.02 162.85 25.81 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 107.82 -2.112 . . . . 0.0 107.82 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 70.8 m -163.47 -84.44 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.239 0 C-N-CA 125.748 1.619 . . . . 0.0 106.991 179.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 69.44 169.73 6.85 Favored Glycine 0 CA--C 1.53 0.983 0 CA-C-O 122.074 0.819 . . . . 0.0 112.053 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 34.3 t -132.0 140.15 48.85 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.188 1.395 . . . . 0.0 107.313 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.68 -168.22 20.42 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 123.751 0.691 . . . . 0.0 112.791 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.4 t -174.94 117.45 0.18 Allowed 'General case' 0 C--O 1.237 0.4 0 C-N-CA 128.266 2.626 . . . . 0.0 105.802 178.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -156.39 36.14 0.59 Allowed Glycine 0 CA--C 1.524 0.597 0 CA-C-O 119.347 -0.696 . . . . 0.0 113.491 -179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.3 m -64.04 173.11 2.01 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.135 0.967 . . . . 0.0 108.985 178.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.03 -165.31 25.34 Favored Glycine 0 CA--C 1.523 0.541 0 O-C-N 121.352 -0.842 . . . . 0.0 113.798 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.264 45.8 p 54.74 35.06 23.12 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 127.584 2.354 . . . . 0.0 113.034 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -144.77 -177.91 19.98 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -112.38 14.26 20.36 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 124.893 1.277 . . . . 0.0 108.741 179.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -66.26 155.75 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 127.761 2.424 . . . . 0.0 109.747 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 12.3 mt -72.9 98.85 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 CA-C-O 122.265 1.031 . . . . 0.0 109.377 -179.293 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -67.98 -7.33 27.98 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 126.251 1.82 . . . . 0.0 112.104 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.251 7.5 t -129.6 44.92 2.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.09 0.956 . . . . 0.0 111.978 -178.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 22.2 t80 -151.21 -52.79 0.13 Allowed 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.82 -1.175 . . . . 0.0 112.165 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.8 9.35 8.84 Favored 'General case' 0 C--O 1.222 -0.342 0 C-N-CA 124.686 1.194 . . . . 0.0 110.851 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.95 -27.66 14.0 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 -178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -76.63 -33.19 58.38 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 121.314 0.578 . . . . 0.0 110.759 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -80.88 -37.9 28.98 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 120.79 -1.194 . . . . 0.0 108.993 177.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -55.11 -42.59 65.93 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 126.672 1.989 . . . . 0.0 111.209 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . 0.407 ' HA ' ' HG3' ' A' 3301 ' ' GLN . 0.1 OUTLIER -63.69 -38.57 91.62 Favored 'General case' 0 N--CA 1.451 -0.413 0 O-C-N 124.108 0.88 . . . . 0.0 109.257 -179.59 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 45.4 t -62.71 -46.56 87.56 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.12 0.568 . . . . 0.0 110.284 -179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . 0.279 12.6 p -76.83 -33.83 21.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 O-C-N 121.854 -0.529 . . . . 0.0 112.072 -178.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.407 ' HG3' ' HA ' ' A' 3298 ' ' GLU . 0.0 OUTLIER -70.02 -32.03 69.98 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 119.299 -2.126 . . . . 0.0 109.128 178.351 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 16.2 mtpp -58.16 -27.7 64.04 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 125.157 1.383 . . . . 0.0 109.596 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -76.18 -49.32 17.55 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 178.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . 0.407 HD12 ' HB3' ' A' ' 16' ' ' LEU . 45.1 mt -65.28 -34.52 78.53 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 115.473 1.657 . . . . 0.0 115.473 -177.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 14.5 pt-20 -67.8 -9.93 48.51 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.1 1.889 . . . . 0.0 116.1 -178.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.6 p30 -114.22 -2.02 13.48 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 124.032 0.933 . . . . 0.0 109.767 177.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.22 156.84 25.45 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 6.1 m -86.63 170.17 12.06 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 127.855 2.462 . . . . 0.0 111.642 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -62.37 -46.4 88.82 Favored 'General case' 0 C--O 1.211 -0.945 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 -52.28 -29.24 22.29 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 119.657 1.117 . . . . 0.0 112.347 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -81.45 -52.86 6.81 Favored 'General case' 0 N--CA 1.436 -1.148 0 O-C-N 121.086 -1.009 . . . . 0.0 110.959 177.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.8 -53.75 7.52 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -177.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 1.8 tm? -54.73 -41.33 70.22 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 128.204 2.601 . . . . 0.0 106.685 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.62 -26.67 67.19 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 119.434 -0.906 . . . . 0.0 112.129 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.83 -57.31 3.95 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 119.471 1.032 . . . . 0.0 111.129 -179.004 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.524 HD21 HD12 ' A' ' 11' ' ' LEU . 2.8 pp -62.94 -25.94 68.59 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.83 1.652 . . . . 0.0 111.988 179.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -94.9 -18.73 20.88 Favored 'General case' 0 C--N 1.332 -0.169 0 O-C-N 123.762 0.664 . . . . 0.0 111.356 179.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 60.64 57.87 16.75 Favored Glycine 0 C--N 1.332 0.319 0 N-CA-C 108.068 -2.013 . . . . 0.0 108.068 -179.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -145.47 -155.45 0.61 Allowed 'General case' 0 C--O 1.234 0.246 0 C-N-CA 124.137 0.975 . . . . 0.0 111.06 -178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 14.3 tp60 -135.37 31.88 3.14 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.998 1.719 . . . . 0.0 110.933 -179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.415 0 C-N-CA 124.063 0.945 . . . . 0.0 109.518 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.2 ptt? . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.9 m-80 -140.21 13.47 2.41 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 120.673 -1.267 . . . . 0.0 112.274 -179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.7 tt -153.88 174.23 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.155 0 O-C-N 121.502 -0.749 . . . . 0.0 111.663 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -146.42 -54.48 0.25 Allowed 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 124.768 1.227 . . . . 0.0 109.369 -179.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -60.0 -35.61 75.42 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-N 119.178 0.899 . . . . 0.0 111.701 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -75.96 -30.95 58.81 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 98.3 m -68.57 -33.95 74.97 Favored 'General case' 0 N--CA 1.451 -0.396 0 O-C-N 120.295 -1.503 . . . . 0.0 111.335 179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.9 mt -53.65 -29.59 39.11 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 120.198 1.363 . . . . 0.0 108.33 179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -52.94 -44.85 67.38 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 125.396 1.478 . . . . 0.0 110.933 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -70.14 -28.65 65.52 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 117.766 0.257 . . . . 0.0 110.618 179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.677 HD12 HD21 ' A' 3316 ' ' LEU . 3.3 mm? -75.15 -53.62 8.53 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 124.273 1.029 . . . . 0.0 109.15 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -43.38 79.82 Favored 'General case' 0 CA--C 1.501 -0.921 0 O-C-N 120.271 -1.518 . . . . 0.0 111.642 -179.139 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.21 -31.52 72.07 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.204 0.456 . . . . 0.0 110.921 178.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.602 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.36 -39.4 74.64 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 120.284 -1.51 . . . . 0.0 108.604 178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 21.6 t -71.97 -34.61 51.38 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.341 0.657 . . . . 0.0 109.384 178.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -68.94 -38.65 79.6 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.505 -1.372 . . . . 0.0 108.367 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 -57.09 -49.74 74.93 Favored 'General case' 0 C--N 1.346 0.42 0 CA-C-N 119.694 1.134 . . . . 0.0 112.359 179.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -65.19 -39.16 92.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 120.127 1.33 . . . . 0.0 110.555 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mttm -55.8 -29.35 59.59 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-O 117.649 -1.167 . . . . 0.0 110.868 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.403 HD12 HD11 ' A' 3297 ' ' ILE . 5.3 mm -62.06 -42.84 96.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 120.455 1.479 . . . . 0.0 109.52 179.53 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -65.66 -28.95 69.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.872 0.844 . . . . 0.0 110.394 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -78.24 -49.49 13.63 Favored 'General case' 0 N--CA 1.448 -0.573 0 O-C-N 121.19 -0.944 . . . . 0.0 109.351 -178.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -30.28 71.32 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.461 1.028 . . . . 0.0 112.756 -179.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.7 tt -77.69 -46.68 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 109.589 -0.522 . . . . 0.0 109.589 179.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -73.82 -47.29 39.67 Favored 'General case' 0 C--N 1.34 0.178 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -177.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.41 -52.55 9.66 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.3 t 46.71 32.39 1.71 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.368 1.467 . . . . 0.0 111.676 -178.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.1 pp -136.44 -175.28 3.95 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.556 1.542 . . . . 0.0 112.758 -177.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -120.46 -43.54 2.5 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 126.51 1.924 . . . . 0.0 114.312 -179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.435 ' CG2' ' HE2' ' A' ' 32' ' ' LYS . 12.1 t -152.79 31.15 0.5 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.473 0.579 . . . . 0.0 111.062 -178.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 61.72 32.36 18.34 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.257 0.623 . . . . 0.0 110.998 -179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HE2' ' CG2' ' A' ' 30' ' ' THR . 10.3 ttmm -70.88 170.88 11.69 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.541 1.137 . . . . 0.0 109.955 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -74.18 -177.86 3.15 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.997 0.903 . . . . 0.0 111.379 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 174.04 155.25 11.72 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 126.91 2.195 . . . . 0.0 108.588 179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.7 t -175.8 137.65 0.35 Allowed 'General case' 0 C--O 1.237 0.407 0 C-N-CA 125.402 1.481 . . . . 0.0 110.065 179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -136.9 172.31 22.66 Favored Glycine 0 CA--C 1.534 1.271 0 C-N-CA 127.679 2.561 . . . . 0.0 108.608 178.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.3 t -137.89 165.71 25.82 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.575 1.187 . . . . 0.0 109.705 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -95.0 171.49 30.0 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 124.535 1.064 . . . . 0.0 112.514 -179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.7 m -109.34 -96.9 0.39 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.53 -171.44 40.77 Favored Glycine 0 CA--C 1.528 0.882 0 C-N-CA 126.243 1.878 . . . . 0.0 108.492 -179.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 18.9 m -140.45 171.54 14.0 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.145 1.378 . . . . 0.0 108.592 179.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -127.1 167.82 19.42 Favored Glycine 0 CA--C 1.526 0.755 0 C-N-CA 124.028 0.823 . . . . 0.0 111.126 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.5 p -77.02 163.73 26.41 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.095 1.358 . . . . 0.0 111.168 179.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -117.68 155.74 15.98 Favored Glycine 0 CA--C 1.526 0.778 0 N-CA-C 108.939 -1.664 . . . . 0.0 108.939 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.9 t -82.26 71.05 9.32 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.746 0.818 . . . . 0.0 109.325 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 173.77 -169.72 42.8 Favored Glycine 0 CA--C 1.523 0.534 0 N-CA-C 109.954 -1.258 . . . . 0.0 109.954 -179.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.1 p -143.23 164.25 30.71 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 179.183 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 148.17 -169.16 28.89 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 107.403 -2.279 . . . . 0.0 107.403 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -158.02 165.56 34.77 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 118.046 0.923 . . . . 0.0 108.77 179.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 154.13 162.39 11.1 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 126.415 1.959 . . . . 0.0 108.349 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.4 t -173.31 161.92 4.28 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.38 1.872 . . . . 0.0 106.248 179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 162.14 173.49 30.88 Favored Glycine 0 CA--C 1.523 0.583 0 CA-C-N 118.938 0.79 . . . . 0.0 112.858 178.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.2 m -172.5 162.46 5.27 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 127.937 2.495 . . . . 0.0 108.519 179.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -167.08 166.06 38.96 Favored Glycine 0 CA--C 1.531 1.037 0 C-N-CA 126.817 2.151 . . . . 0.0 109.027 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.7 m -160.04 172.61 17.2 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.917 1.687 . . . . 0.0 110.419 -179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 170.56 170.98 35.48 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.674 1.131 . . . . 0.0 110.948 178.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.0 p 151.67 145.86 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 130.429 3.492 . . . . 0.0 111.235 178.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -108.44 -65.17 0.57 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 179.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 75.3 m-85 -88.35 -171.08 3.21 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.215 1.406 . . . . 0.0 109.504 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -57.7 155.82 9.47 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.9 mt -95.2 98.34 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 -179.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -67.29 -7.64 25.96 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.357 1.863 . . . . 0.0 112.751 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 8.1 t -127.48 56.64 1.54 Allowed 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.272 1.429 . . . . 0.0 108.603 -179.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 14.9 t80 -160.63 -64.85 0.06 Allowed 'General case' 0 C--N 1.343 0.302 0 O-C-N 121.69 -0.631 . . . . 0.0 110.99 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -117.5 12.28 14.1 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.072 1.349 . . . . 0.0 112.637 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.4 -30.99 13.66 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 9.3 mm-40 -74.04 -32.2 63.22 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.715 0.689 . . . . 0.0 111.089 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -79.83 -34.36 39.51 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 121.553 -0.717 . . . . 0.0 109.366 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.403 HD11 HD12 ' A' ' 20' ' ' ILE . 1.1 mp -55.68 -47.0 79.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.368 0 C-N-CA 126.725 2.01 . . . . 0.0 109.548 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -65.71 -35.98 82.29 Favored 'General case' 0 N--CA 1.447 -0.61 0 O-C-N 123.4 0.437 . . . . 0.0 109.906 -178.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 5.5 t -69.61 -45.61 68.18 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 123.07 0.548 . . . . 0.0 110.93 -178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.0 p -69.83 -40.03 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.229 0 O-C-N 121.396 -0.815 . . . . 0.0 109.12 -179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.11 -30.6 67.84 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 120.399 -1.438 . . . . 0.0 110.406 178.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 18.3 mtpp -59.13 -27.54 65.72 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.502 1.121 . . . . 0.0 109.433 177.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.08 -34.68 61.81 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.234 0.614 . . . . 0.0 109.685 178.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 80.6 mt -80.24 -34.92 36.8 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 126.746 2.019 . . . . 0.0 116.33 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -57.66 -20.65 35.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 118.993 0.815 . . . . 0.0 113.164 -178.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.1 p30 -104.16 -0.27 28.73 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 118.778 0.717 . . . . 0.0 112.121 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -84.76 157.52 21.0 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.537 0.608 . . . . 0.0 110.312 178.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 72.1 m -86.52 170.29 12.04 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 125.717 1.607 . . . . 0.0 111.313 179.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -59.89 -48.32 82.19 Favored 'General case' 0 C--O 1.209 -1.03 0 O-C-N 121.02 -1.05 . . . . 0.0 108.215 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -52.41 -28.84 21.44 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 118.2 -0.905 . . . . 0.0 112.601 -177.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -80.59 -52.02 8.08 Favored 'General case' 0 N--CA 1.444 -0.768 0 CA-C-O 121.643 0.735 . . . . 0.0 110.78 177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 3.9 mt -75.81 -53.42 8.51 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 125.981 1.713 . . . . 0.0 114.796 -177.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -42.0 67.47 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 128.412 2.685 . . . . 0.0 105.437 178.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.31 69.58 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 113.048 0.758 . . . . 0.0 113.048 -179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -79.28 -55.38 5.12 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 122.955 1.36 . . . . 0.0 111.129 -177.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.677 HD21 HD12 ' A' ' 11' ' ' LEU . 3.2 pp -62.99 -36.72 84.48 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.708 179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -79.9 -26.57 40.16 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 118.348 0.522 . . . . 0.0 110.591 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 81.15 44.01 8.36 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 124.647 1.118 . . . . 0.0 112.991 179.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 38.8 t70 37.09 67.41 0.35 Allowed 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 129.521 3.128 . . . . 0.0 113.146 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -148.98 31.16 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 124.531 1.132 . . . . 0.0 113.373 -179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 . . . . . 0 N--CA 1.435 -1.224 0 C-N-CA 126.298 1.839 . . . . 0.0 107.104 179.32 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.5 mtm . . . . . 0 N--CA 1.473 0.683 0 N-CA-C 110.097 -0.335 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -63.39 146.6 53.22 Favored 'General case' 0 N--CA 1.444 -0.738 0 O-C-N 123.587 0.554 . . . . 0.0 109.767 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 9.8 tt -58.87 155.11 2.75 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 O-C-N 123.388 0.43 . . . . 0.0 110.72 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -133.73 -35.4 0.98 Allowed 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 125.769 1.628 . . . . 0.0 109.191 179.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.3 mt-10 -59.0 -38.53 79.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.42 1.088 . . . . 0.0 110.09 178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.1 mt-30 -77.51 -36.67 52.28 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 118.303 -0.856 . . . . 0.0 109.021 178.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 65.1 m -59.05 -29.44 67.3 Favored 'General case' 0 N--CA 1.461 0.088 0 CA-C-O 117.793 -1.099 . . . . 0.0 112.456 179.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 12.2 mt -52.95 -28.79 25.28 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 178.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -51.77 -50.38 60.8 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.373 1.469 . . . . 0.0 110.784 178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.98 -29.05 70.24 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 118.707 0.685 . . . . 0.0 111.421 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.437 HD12 HD21 ' A' 3316 ' ' LEU . 2.9 mm? -75.6 -54.75 6.48 Favored 'General case' 0 N--CA 1.445 -0.72 0 C-N-CA 124.815 1.246 . . . . 0.0 109.699 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.07 -42.58 94.86 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 119.868 -1.77 . . . . 0.0 111.996 -178.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -62.71 -30.4 71.38 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.92 0.888 . . . . 0.0 110.169 178.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.411 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.34 -45.2 40.99 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 120.997 -1.064 . . . . 0.0 108.248 178.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.438 HG23 HD23 ' A' 3316 ' ' LEU . 66.8 t -63.89 -46.53 93.94 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 O-C-N 121.522 -0.736 . . . . 0.0 109.428 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.5 pp -58.62 -32.65 69.21 Favored 'General case' 0 C--N 1.34 0.176 0 O-C-N 121.198 -0.939 . . . . 0.0 111.0 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.84 -45.37 94.76 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-O 117.971 -1.014 . . . . 0.0 109.84 178.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.84 -37.37 81.82 Favored 'General case' 0 C--N 1.348 0.536 0 CA-C-N 120.749 1.613 . . . . 0.0 109.676 179.225 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -56.13 -33.84 65.54 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 117.298 -1.334 . . . . 0.0 111.151 -179.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.485 HD12 HD11 ' A' 3297 ' ' ILE . 6.2 mm -60.93 -48.44 88.98 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-N 120.025 1.284 . . . . 0.0 108.015 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.7 mttt -61.78 -29.17 69.96 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 124.841 1.257 . . . . 0.0 109.899 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -75.51 -49.9 17.31 Favored 'General case' 0 N--CA 1.449 -0.517 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -178.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.7 -42.31 97.99 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 119.349 0.977 . . . . 0.0 111.252 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.3 tt -68.27 -44.03 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 CA-C-N 119.334 0.97 . . . . 0.0 111.986 -179.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -76.19 -48.18 21.38 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 118.977 0.808 . . . . 0.0 112.958 -177.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.5 m-80 -70.61 -50.5 36.45 Favored 'General case' 0 CA--C 1.52 -0.175 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 t 44.92 49.66 9.13 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.07 1.348 . . . . 0.0 110.366 179.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.8 pp -150.2 -174.34 4.7 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.346 1.07 . . . . 0.0 110.914 -178.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.7 m -124.61 -46.49 1.87 Allowed 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 127.18 2.192 . . . . 0.0 111.364 -179.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.8 t -154.74 33.33 0.4 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.864 0.866 . . . . 0.0 109.877 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 66.29 31.33 8.53 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 120.991 -1.068 . . . . 0.0 110.546 -178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -71.93 166.99 21.02 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 178.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -70.53 -52.89 18.63 Favored 'General case' 0 C--O 1.233 0.188 0 O-C-N 121.354 -0.841 . . . . 0.0 109.1 178.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 46.19 66.92 1.5 Allowed Glycine 0 CA--C 1.527 0.811 0 C-N-CA 126.009 1.766 . . . . 0.0 114.342 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.9 t -124.03 -172.17 2.48 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 124.201 1.001 . . . . 0.0 108.517 178.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 125.78 95.88 1.02 Allowed Glycine 0 CA--C 1.523 0.542 0 C-N-CA 124.803 1.192 . . . . 0.0 111.47 179.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.9 m -144.8 165.14 28.96 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.33 1.452 . . . . 0.0 108.734 178.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.0 103.18 0.17 Allowed Glycine 0 CA--C 1.524 0.633 0 N-CA-C 109.469 -1.453 . . . . 0.0 109.469 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 82.8 p -150.86 175.26 12.2 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 118.584 1.192 . . . . 0.0 111.511 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -157.87 -68.56 0.01 OUTLIER Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.635 -0.586 . . . . 0.0 111.635 179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.2 t 64.78 7.25 3.75 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 125.869 1.668 . . . . 0.0 115.031 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -160.42 165.33 34.9 Favored Glycine 0 C--N 1.334 0.431 0 CA-C-N 120.654 1.57 . . . . 0.0 109.511 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.9 p -122.54 -22.02 5.55 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.995 1.318 . . . . 0.0 113.162 -179.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 144.86 92.17 0.13 Allowed Glycine 0 C--N 1.337 0.587 0 N-CA-C 107.767 -2.133 . . . . 0.0 107.767 -179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -147.77 84.43 1.54 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 -179.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 163.01 -170.8 38.62 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 108.982 -1.647 . . . . 0.0 108.982 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.8 t -153.17 -92.43 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 104.226 -2.509 . . . . 0.0 104.226 179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -68.89 153.99 53.15 Favored Glycine 0 CA--C 1.529 0.944 0 N-CA-C 108.391 -1.883 . . . . 0.0 108.391 178.272 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 30.5 p -153.4 -176.83 5.98 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 124.608 1.163 . . . . 0.0 108.321 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.49 165.65 30.99 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.542 -1.023 . . . . 0.0 110.542 179.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 42.7 t -160.48 168.77 24.39 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -176.51 163.17 32.16 Favored Glycine 0 CA--C 1.523 0.589 0 N-CA-C 109.295 -1.522 . . . . 0.0 109.295 179.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.8 t -147.18 -173.58 4.28 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 106.827 -1.546 . . . . 0.0 106.827 179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -160.12 172.54 36.62 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 125.61 1.576 . . . . 0.0 109.528 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 5.2 t 176.59 179.98 0.19 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.751 2.82 . . . . 0.0 107.656 179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 147.86 -167.32 28.8 Favored Glycine 0 CA--C 1.522 0.487 0 N-CA-C 111.097 -0.801 . . . . 0.0 111.097 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 p -118.39 156.76 28.41 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 63.55 -175.1 9.8 Favored Glycine 0 CA--C 1.529 0.94 0 C-N-CA 124.389 0.995 . . . . 0.0 110.728 -178.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 48.94 85.3 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.885 1.674 . . . . 0.0 112.016 179.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -59.4 157.29 11.36 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.188 0.595 . . . . 0.0 111.046 179.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 35.6 mt -97.03 89.62 2.11 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 N-CA-C 107.721 -1.215 . . . . 0.0 107.721 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -67.48 -6.21 18.49 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.205 1.802 . . . . 0.0 113.349 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . 0.254 11.8 t -121.73 41.32 3.39 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 125.407 1.483 . . . . 0.0 110.497 -179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.4 t80 -152.91 -58.34 0.14 Allowed 'General case' 0 C--N 1.34 0.163 0 C-N-CA 123.96 0.904 . . . . 0.0 109.886 179.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -122.58 14.75 10.25 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 123.961 0.904 . . . . 0.0 112.697 -178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -52.39 -34.43 48.0 Favored 'General case' 0 C--N 1.333 -0.11 0 CA-C-N 119.962 1.256 . . . . 0.0 113.485 -179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -76.83 -25.01 52.72 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 123.955 0.784 . . . . 0.0 111.116 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 80.4 m-20 -80.33 -38.16 31.13 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.348 1.059 . . . . 0.0 110.046 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.485 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -53.89 -46.13 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 126.917 2.087 . . . . 0.0 110.841 -179.352 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -64.58 -36.81 85.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.118 0.485 . . . . 0.0 110.033 -179.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 48.0 t -69.36 -48.58 60.86 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 123.53 0.732 . . . . 0.0 110.171 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 10.4 p -72.89 -34.57 46.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 O-C-N 121.197 -0.939 . . . . 0.0 110.68 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -31.1 66.43 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.4 -2.063 . . . . 0.0 110.388 178.051 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -55.36 -28.13 51.89 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.657 1.183 . . . . 0.0 111.384 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -77.12 -42.56 37.5 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-O 121.397 0.617 . . . . 0.0 109.584 179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 10.1 mt -71.38 -31.92 67.87 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 115.223 1.564 . . . . 0.0 115.223 -178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.62 -15.47 51.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 118.349 -0.834 . . . . 0.0 112.713 -179.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 11.7 p30 -105.28 -1.94 24.63 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 118.866 0.757 . . . . 0.0 110.781 178.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.02 154.87 20.43 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 119.929 1.241 . . . . 0.0 110.835 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 57.5 m -83.64 168.65 16.12 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.412 1.485 . . . . 0.0 110.019 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.0 mt-10 -60.36 -43.87 96.13 Favored 'General case' 0 C--O 1.21 -1.0 0 O-C-N 120.94 -1.1 . . . . 0.0 108.111 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -53.05 -29.36 29.47 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 121.0 -1.062 . . . . 0.0 110.903 -177.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 52.9 mm-40 -81.98 -53.58 6.02 Favored 'General case' 0 N--CA 1.433 -1.32 0 O-C-N 121.482 -0.761 . . . . 0.0 111.158 178.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.9 mt -76.13 -53.66 7.97 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 115.366 1.617 . . . . 0.0 115.366 -177.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.422 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.5 -39.88 68.01 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 127.716 2.406 . . . . 0.0 106.916 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -69.46 -27.33 65.14 Favored 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 119.613 -0.835 . . . . 0.0 112.123 -179.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -73.57 -55.34 6.44 Favored 'General case' 0 CA--C 1.511 -0.529 0 O-C-N 120.897 -1.127 . . . . 0.0 109.712 -178.684 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.438 HD23 HG23 ' A' ' 15' ' ' VAL . 3.7 pp -62.39 -39.02 91.84 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.392 179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -77.37 -26.82 52.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 118.238 0.472 . . . . 0.0 110.893 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 78.37 23.2 65.94 Favored Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.324 1.44 . . . . 0.0 112.127 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -115.22 -164.68 0.96 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 126.143 1.777 . . . . 0.0 109.42 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -140.6 25.3 2.2 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.428 1.091 . . . . 0.0 112.717 179.56 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.92 0 C-N-CA 127.159 2.184 . . . . 0.0 107.844 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 16.6 ptm . . . . . 0 N--CA 1.476 0.867 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.257 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.84 115.96 12.76 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 103.12 -2.919 . . . . 0.0 103.12 178.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 4.1 tt -62.08 158.29 3.13 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 -179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -134.81 -42.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 124.564 1.146 . . . . 0.0 109.54 -179.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -59.12 -40.11 84.39 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 119.565 1.075 . . . . 0.0 109.074 179.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 -76.22 -26.32 55.95 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.089 0.955 . . . . 0.0 110.303 178.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 92.4 m -76.03 -27.27 57.25 Favored 'General case' 0 C--O 1.224 -0.27 0 O-C-N 120.945 -1.097 . . . . 0.0 110.629 178.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' 3309 ' ' GLU . 36.1 mt -52.97 -29.75 30.85 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 120.727 1.603 . . . . 0.0 107.634 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.428 ' HA ' ' HE ' ' A' ' 12' ' ' ARG . 1.4 m-20 -51.48 -48.55 62.83 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 126.015 1.726 . . . . 0.0 111.281 179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -66.52 -28.66 68.73 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.295 0.952 . . . . 0.0 110.696 -179.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.56 HD12 HD21 ' A' 3316 ' ' LEU . 2.7 mm? -75.89 -53.24 8.74 Favored 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.285 1.434 . . . . 0.0 110.205 179.675 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.485 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 16.1 ptt180 -59.55 -41.35 89.89 Favored 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 120.609 -1.307 . . . . 0.0 111.663 -178.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.8 pp0? -65.15 -31.34 72.49 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.524 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -72.23 -44.23 63.23 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 120.628 -1.295 . . . . 0.0 108.915 178.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.421 HG23 HD23 ' A' 3316 ' ' LEU . 43.8 t -65.87 -48.12 83.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.43 ' HB3' ' CD1' ' A' 3304 ' ' LEU . 2.5 pp -57.54 -38.28 74.45 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 120.569 -1.332 . . . . 0.0 110.563 179.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -57.18 -48.75 77.96 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.266 0.939 . . . . 0.0 110.252 178.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -64.67 -38.08 89.78 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.602 1.092 . . . . 0.0 111.05 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -56.44 -32.99 65.44 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 117.964 -1.017 . . . . 0.0 111.479 -178.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.412 HD12 HD11 ' A' 3297 ' ' ILE . 3.8 mm -65.79 -36.59 77.93 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-N 119.405 1.002 . . . . 0.0 109.385 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -30.36 62.11 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 124.432 1.093 . . . . 0.0 110.366 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 83.8 mt-10 -72.09 -50.15 30.58 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.48 -35.38 77.49 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 118.973 0.806 . . . . 0.0 113.002 -179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.9 tt -76.96 -41.93 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 119.085 0.857 . . . . 0.0 110.82 179.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.77 -47.59 37.83 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-N 118.769 0.713 . . . . 0.0 112.522 -178.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -76.88 -52.64 9.09 Favored 'General case' 0 N--CA 1.453 -0.28 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 -179.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 t 45.29 42.2 6.99 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.423 1.089 . . . . 0.0 110.783 -179.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.483 HD13 ' H ' ' A' ' 31' ' ' GLU . 3.6 pp -147.72 -175.75 4.99 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 124.697 1.199 . . . . 0.0 111.007 -177.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.4 m -113.75 -51.22 2.8 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 125.513 1.525 . . . . 0.0 111.337 179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 15.3 t -155.51 37.94 0.38 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 122.143 0.973 . . . . 0.0 109.537 -178.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.483 ' H ' HD13 ' A' ' 28' ' ' LEU . 20.2 mt-10 64.82 13.38 8.45 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.747 -1.221 . . . . 0.0 111.973 -179.126 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.05 -68.33 0.18 Allowed 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 125.887 1.675 . . . . 0.0 111.086 -178.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -167.25 166.42 14.8 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.727 0.811 . . . . 0.0 110.268 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -174.11 147.7 9.48 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 126.685 2.088 . . . . 0.0 108.36 179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.1 m -167.06 177.8 6.06 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.969 1.708 . . . . 0.0 109.87 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -175.61 160.34 28.65 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 109.809 -1.316 . . . . 0.0 109.809 178.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 4.3 m -170.86 178.84 3.35 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 128.004 2.522 . . . . 0.0 107.874 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 105.57 0.27 Allowed Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 110.036 -1.225 . . . . 0.0 110.036 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.9 t -143.66 171.1 14.65 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.775 1.23 . . . . 0.0 109.355 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 125.22 -34.39 3.39 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 124.836 1.208 . . . . 0.0 113.744 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 80.3 p -71.17 18.32 0.07 Allowed 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 119.462 1.631 . . . . 0.0 114.453 -179.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -107.59 82.36 0.31 Allowed Glycine 0 C--N 1.333 0.4 0 N-CA-C 106.584 -2.606 . . . . 0.0 106.584 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.7 m -147.64 162.36 39.29 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 125.039 1.336 . . . . 0.0 108.302 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 175.84 176.57 44.18 Favored Glycine 0 CA--C 1.524 0.631 0 N-CA-C 109.363 -1.495 . . . . 0.0 109.363 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.0 p -82.02 62.57 5.85 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.372 1.069 . . . . 0.0 108.524 179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 130.13 -155.75 21.18 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 108.319 -1.912 . . . . 0.0 108.319 -178.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.4 m -92.66 151.34 20.14 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.517 0.727 . . . . 0.0 110.61 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -80.43 113.13 3.58 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 108.345 -1.902 . . . . 0.0 108.345 179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 3.0 p -75.7 2.87 10.89 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 124.814 1.245 . . . . 0.0 113.408 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -163.4 169.93 38.63 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 109.296 -1.521 . . . . 0.0 109.296 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 20.9 m -120.13 175.9 5.71 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 125.131 1.373 . . . . 0.0 111.413 -178.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -96.19 168.64 25.88 Favored Glycine 0 CA--C 1.525 0.675 0 N-CA-C 110.143 -1.183 . . . . 0.0 110.143 179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.3 m -143.43 143.5 31.64 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -99.73 171.67 24.11 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 109.107 -1.597 . . . . 0.0 109.107 178.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 14.5 m -153.49 -177.1 6.13 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.903 1.681 . . . . 0.0 108.564 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -131.21 -175.33 13.96 Favored Glycine 0 CA--C 1.529 0.947 0 C-N-CA 126.245 1.879 . . . . 0.0 109.911 179.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.2 m -127.28 -93.38 0.47 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.402 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -174.53 -75.58 0.05 OUTLIER Glycine 0 C--N 1.338 0.686 0 CA-C-N 120.179 1.354 . . . . 0.0 112.698 -179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.8 t80 -74.17 -161.88 0.13 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.761 1.224 . . . . 0.0 111.031 -179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -65.21 178.05 0.96 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.471 -0.768 . . . . 0.0 111.747 179.447 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 14.4 mt -113.42 92.08 1.97 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.182 0 CA-C-O 121.922 0.868 . . . . 0.0 109.627 -177.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -69.83 -9.76 55.94 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.909 1.684 . . . . 0.0 110.974 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 13.9 t -123.65 62.84 1.05 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.389 1.476 . . . . 0.0 107.598 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 2.0 t80 -167.19 -77.64 0.02 OUTLIER 'General case' 0 C--N 1.347 0.481 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.77 18.17 20.47 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.018 1.727 . . . . 0.0 113.656 -178.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.5 -31.81 16.45 Favored 'General case' 0 C--O 1.23 0.052 0 N-CA-C 114.395 1.258 . . . . 0.0 114.395 -178.729 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 92.0 mm-40 -75.51 -36.99 60.43 Favored 'General case' 0 C--O 1.223 -0.33 0 O-C-N 123.863 0.727 . . . . 0.0 111.72 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -76.33 -28.26 56.84 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.423 -0.798 . . . . 0.0 109.553 179.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . 0.412 HD11 HD12 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -56.3 -46.12 81.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.581 1.153 . . . . 0.0 111.017 -178.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -69.45 -37.17 77.22 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.082 0.553 . . . . 0.0 109.697 -179.075 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 18.5 t -67.02 -39.3 87.01 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.969 0.89 . . . . 0.0 109.525 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 43.0 t -70.79 -48.44 57.35 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 C-N-CA 124.98 1.312 . . . . 0.0 108.607 -179.015 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.47 -30.97 71.81 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.129 -0.982 . . . . 0.0 110.677 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 31.2 mtpt -60.98 -29.54 69.74 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 124.427 1.091 . . . . 0.0 109.22 177.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.09 -37.26 66.81 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . 0.43 ' CD1' ' HB3' ' A' ' 16' ' ' LEU . 74.8 mt -80.22 -35.15 36.59 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 116.667 2.099 . . . . 0.0 116.667 -178.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . 0.485 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 24.8 pt-20 -62.84 -20.88 65.5 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 114.097 1.147 . . . . 0.0 114.097 -178.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 4.8 p30 -105.79 6.25 31.55 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 122.972 0.509 . . . . 0.0 109.98 178.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -92.92 149.98 20.88 Favored 'General case' 0 C--N 1.341 0.216 0 CA-C-N 118.776 0.716 . . . . 0.0 110.648 -179.063 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 62.6 m -79.48 167.38 20.87 Favored 'General case' 0 N--CA 1.463 0.203 0 C-N-CA 125.325 1.45 . . . . 0.0 111.319 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.45 ' HG3' HD23 ' A' ' 8' ' ' LEU . 2.4 mt-10 -59.92 -50.6 73.12 Favored 'General case' 0 C--O 1.205 -1.265 0 N-CA-C 106.787 -1.56 . . . . 0.0 106.787 178.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 19.4 pt-20 -52.13 -28.57 18.36 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 119.842 1.201 . . . . 0.0 112.362 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.18 -51.09 8.81 Favored 'General case' 0 N--CA 1.433 -1.312 0 O-C-N 120.745 -1.222 . . . . 0.0 110.788 178.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.6 mt -75.54 -53.43 8.64 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 125.148 1.379 . . . . 0.0 113.439 -177.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.425 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.32 -41.16 68.69 Favored 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 128.248 2.619 . . . . 0.0 106.015 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -66.04 -27.41 68.08 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 119.251 -0.98 . . . . 0.0 112.79 -179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -77.75 -55.55 5.24 Favored 'General case' 0 CA--C 1.515 -0.4 0 O-C-N 121.034 -1.041 . . . . 0.0 110.655 -178.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.56 HD21 HD12 ' A' ' 11' ' ' LEU . 3.0 pp -61.64 -35.16 77.13 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.382 179.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -79.49 -26.54 41.61 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 121.077 0.465 . . . . 0.0 110.716 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.52 46.85 37.83 Favored Glycine 0 CA--C 1.524 0.602 0 N-CA-C 108.04 -2.024 . . . . 0.0 108.04 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -126.34 -170.27 2.17 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.727 1.611 . . . . 0.0 111.124 -179.139 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -121.52 28.45 7.71 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.147 2.179 . . . . 0.0 110.604 -179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 . . . . . 0 C--O 1.241 0.653 0 C-N-CA 125.881 1.672 . . . . 0.0 109.883 -179.252 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.8 mtp . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 119.227 -0.416 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -78.62 80.25 5.01 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -178.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 15.0 tt -153.44 156.62 5.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 126.219 1.807 . . . . 0.0 107.54 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p-10 -124.1 -41.38 2.21 Favored 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 124.48 1.112 . . . . 0.0 109.229 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -59.1 -36.71 75.61 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.017 0.927 . . . . 0.0 111.099 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -76.61 -30.63 57.01 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 123.269 0.627 . . . . 0.0 110.001 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.4 m -68.33 -37.96 81.07 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.964 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 7.2 mt -52.9 -29.37 27.99 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 120.153 1.342 . . . . 0.0 109.311 -178.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -52.53 -44.18 65.61 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.389 1.476 . . . . 0.0 111.332 179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.415 ' HG2' HD22 ' A' ' 11' ' ' LEU . 14.7 ptmt -71.28 -28.64 64.28 Favored 'General case' 0 N--CA 1.464 0.271 0 O-C-N 122.066 -0.396 . . . . 0.0 110.067 179.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.782 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -75.81 -52.45 10.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.159 0.984 . . . . 0.0 110.37 179.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.12 -42.24 80.5 Favored 'General case' 0 CA--C 1.515 -0.376 0 O-C-N 120.823 -1.173 . . . . 0.0 110.58 -179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.48 -31.01 71.48 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 118.504 0.593 . . . . 0.0 110.82 178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.588 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -71.17 -43.72 66.94 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 120.891 -1.13 . . . . 0.0 108.255 178.413 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.661 HG23 HD23 ' A' 3316 ' ' LEU . 73.6 t -66.12 -50.13 71.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.691 1.596 . . . . 0.0 110.816 179.393 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -52.58 -37.45 58.03 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.245 0.93 . . . . 0.0 111.612 -178.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -56.87 -46.57 81.73 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 117.932 -1.032 . . . . 0.0 111.186 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.42 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -66.05 -35.85 81.64 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 120.927 1.694 . . . . 0.0 111.204 -179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.481 ' HE2' HD21 ' A' 3304 ' ' LEU . 19.6 mttp -59.67 -34.11 72.42 Favored 'General case' 0 C--O 1.23 0.037 0 C-N-CA 123.702 0.801 . . . . 0.0 110.607 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 4.0 mm -64.87 -35.39 75.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.42 ' HE3' ' HA ' ' A' ' 18' ' ' LYS . 6.0 mtmp? -71.16 -29.48 65.26 Favored 'General case' 0 C--O 1.225 -0.221 0 C-N-CA 123.572 0.749 . . . . 0.0 109.925 178.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -71.0 -49.8 41.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 118.187 -0.911 . . . . 0.0 108.75 -179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.61 -45.02 95.85 Favored 'General case' 0 C--O 1.222 -0.353 0 CA-C-N 118.92 0.782 . . . . 0.0 111.456 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.1 tt -65.59 -40.52 88.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 119.534 1.061 . . . . 0.0 112.121 179.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -75.83 -47.5 25.39 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.927 0.785 . . . . 0.0 113.078 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -77.44 -51.47 10.72 Favored 'General case' 0 C--O 1.219 -0.539 0 O-C-N 121.731 -0.606 . . . . 0.0 111.519 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.9 0.7 0.12 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 126.818 2.047 . . . . 0.0 114.92 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.3 pp -100.75 -177.9 3.61 Favored 'General case' 0 N--CA 1.445 -0.719 0 C-N-CA 128.172 2.589 . . . . 0.0 111.205 -179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 51.7 m -134.81 -41.45 0.76 Allowed 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 125.646 1.578 . . . . 0.0 111.67 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.7 t -157.92 37.0 0.26 Allowed 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 53.98 31.49 13.6 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.302 1.049 . . . . 0.0 109.414 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 10.8 ttpt -65.6 150.35 48.57 Favored 'General case' 0 N--CA 1.443 -0.808 0 C-N-CA 127.233 2.213 . . . . 0.0 109.283 -178.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -131.81 170.14 15.25 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.227 1.011 . . . . 0.0 108.842 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 128.53 111.99 1.62 Allowed Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 107.927 -2.069 . . . . 0.0 107.927 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.7 m -135.13 165.29 25.72 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.272 1.829 . . . . 0.0 108.524 179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -174.7 -166.52 32.75 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 108.952 -1.659 . . . . 0.0 108.952 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 11.2 t -60.7 157.61 14.35 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.19 0.995 . . . . 0.0 108.96 179.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -116.36 -13.96 7.91 Favored Glycine 0 CA--C 1.524 0.63 0 CA-C-O 119.268 -0.74 . . . . 0.0 113.418 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 4.0 m -64.02 121.37 13.96 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.715 1.257 . . . . 0.0 109.405 -179.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 149.96 -172.96 29.79 Favored Glycine 0 CA--C 1.525 0.707 0 N-CA-C 109.253 -1.539 . . . . 0.0 109.253 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.6 t -128.65 159.65 34.92 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 167.39 94.81 0.1 OUTLIER Glycine 0 N--CA 1.443 -0.837 0 N-CA-C 106.236 -2.746 . . . . 0.0 106.236 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 43.2 m -58.71 -50.68 73.01 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 117.88 0.84 . . . . 0.0 110.969 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 149.5 -140.67 8.27 Favored Glycine 0 N--CA 1.447 -0.591 0 N-CA-C 108.77 -1.732 . . . . 0.0 108.77 -179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -148.7 -40.09 0.16 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 117.662 0.731 . . . . 0.0 110.643 -179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.07 164.27 39.9 Favored Glycine 0 CA--C 1.529 0.933 0 N-CA-C 110.314 -1.115 . . . . 0.0 110.314 -179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.6 m -139.29 -1.44 1.72 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.424 1.09 . . . . 0.0 113.279 -179.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 178.39 156.41 16.76 Favored Glycine 0 CA--C 1.523 0.572 0 CA-C-N 119.603 1.092 . . . . 0.0 110.72 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 5.8 p -75.22 -71.42 0.36 Allowed 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 124.014 0.926 . . . . 0.0 109.813 -179.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 165.4 -178.59 40.26 Favored Glycine 0 CA--C 1.524 0.629 0 C-N-CA 126.098 1.809 . . . . 0.0 109.581 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 46.8 t -154.19 -88.11 0.05 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 103.6 -2.741 . . . . 0.0 103.6 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.64 -171.18 36.2 Favored Glycine 0 CA--C 1.534 1.224 0 N-CA-C 108.354 -1.898 . . . . 0.0 108.354 177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.9 m -118.28 3.96 11.93 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.696 -0.884 . . . . 0.0 112.976 179.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 66.31 178.65 9.08 Favored Glycine 0 C--N 1.338 0.674 0 CA-C-O 122.257 0.921 . . . . 0.0 112.315 179.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 12.5 t -172.56 -138.84 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 104.548 -2.39 . . . . 0.0 104.548 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 119.9 179.73 16.5 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 125.371 1.462 . . . . 0.0 109.749 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 38.6 t -163.28 175.18 11.16 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 96.8 49.9 1.88 Allowed Glycine 0 C--N 1.332 0.355 0 C-N-CA 124.809 1.195 . . . . 0.0 111.333 179.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 51.16 39.0 22.52 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.234 1.414 . . . . 0.0 111.958 179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 16.0 pt20 -63.91 170.74 3.25 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 121.254 0.55 . . . . 0.0 111.755 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 18.7 mt -107.82 85.26 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 105.187 -2.153 . . . . 0.0 105.187 -179.039 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 39.4 tp10 -60.04 -10.17 3.95 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 128.184 2.593 . . . . 0.0 114.674 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 4.9 t -129.57 44.52 2.95 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.907 1.683 . . . . 0.0 108.741 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 26.0 t80 -146.3 -60.04 0.31 Allowed 'General case' 0 N--CA 1.467 0.411 0 O-C-N 120.645 -1.284 . . . . 0.0 111.612 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -122.92 9.78 9.44 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 124.769 1.228 . . . . 0.0 112.202 -179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -51.12 -32.34 22.36 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.901 0.773 . . . . 0.0 112.137 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 51.9 mm-40 -70.15 -34.07 72.57 Favored 'General case' 0 C--O 1.22 -0.493 0 CA-C-N 118.854 0.752 . . . . 0.0 110.655 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -79.58 -25.46 41.56 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.539 0.736 . . . . 0.0 110.328 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.1 mp -59.8 -45.84 94.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 C-N-CA 125.246 1.419 . . . . 0.0 109.258 179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -32.66 73.97 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.642 0.655 . . . . 0.0 110.497 -179.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 36.5 t -70.5 -45.47 65.55 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 123.915 0.886 . . . . 0.0 110.508 -179.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.1 p -75.81 -37.06 34.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 O-C-N 121.134 -0.979 . . . . 0.0 110.382 -179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.72 -31.34 71.93 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 120.597 -1.314 . . . . 0.0 110.16 -179.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 20.2 mttt -63.58 -36.09 82.64 Favored 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 124.058 0.943 . . . . 0.0 108.764 177.107 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.22 -42.48 99.34 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.112 179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . 0.481 HD21 ' HE2' ' A' ' 19' ' ' LYS . 68.1 mt -80.71 -35.43 33.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 117.347 2.351 . . . . 0.0 117.347 -179.032 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -59.76 -18.85 46.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 120.341 1.428 . . . . 0.0 113.073 -179.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 10.8 p30 -98.93 -5.33 30.91 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 123.813 0.845 . . . . 0.0 110.983 179.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.5 153.67 21.68 Favored 'General case' 0 C--N 1.341 0.213 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 178.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 49.9 m -86.15 170.63 12.0 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 122.874 0.47 . . . . 0.0 110.368 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.26 -50.59 70.92 Favored 'General case' 0 C--O 1.207 -1.172 0 CA-C-O 117.642 -1.171 . . . . 0.0 108.159 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -53.04 -28.07 22.78 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 120.386 1.448 . . . . 0.0 111.887 -177.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 31.6 mm-40 -80.02 -51.18 9.37 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.62 0.646 . . . . 0.0 111.666 178.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 4.9 mt -76.36 -52.53 9.73 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 125.456 1.502 . . . . 0.0 113.643 -177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' A' 3309 ' ' GLU . 2.2 tm? -54.65 -41.73 70.46 Favored 'General case' 0 CA--C 1.513 -0.48 0 C-N-CA 128.805 2.842 . . . . 0.0 106.372 178.85 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.16 -29.04 69.84 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.014 -179.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -79.25 -55.53 5.02 Favored 'General case' 0 CA--C 1.513 -0.479 0 O-C-N 121.067 -1.021 . . . . 0.0 111.239 -178.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.782 HD21 HD12 ' A' ' 11' ' ' LEU . 3.1 pp -60.89 -32.75 72.19 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-O 118.431 -0.795 . . . . 0.0 111.421 -179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -89.09 -21.91 23.16 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 124.049 0.843 . . . . 0.0 112.56 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 71.89 61.44 3.78 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 126.451 1.977 . . . . 0.0 113.753 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 13.8 m-20 30.26 64.4 0.16 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 129.218 3.007 . . . . 0.0 111.591 179.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . 0.53 ' H ' ' NE2' ' A' 3321 ' ' GLN . 28.5 tt0 -147.11 68.82 1.15 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.521 1.528 . . . . 0.0 108.144 -178.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . 0.53 ' NE2' ' H ' ' A' 3320 ' ' GLN . 1.8 mp0 . . . . . 0 C--O 1.251 1.165 0 C-N-CA 124.826 1.251 . . . . 0.0 108.976 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 9.2 mmt . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 35.3 m120 -62.53 128.25 35.12 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 -179.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 10.9 tt -59.84 148.1 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 CA-C-O 121.933 0.873 . . . . 0.0 111.265 -179.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.1 p-10 -110.15 -49.03 3.11 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 125.873 1.669 . . . . 0.0 111.803 -179.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.6 mt-10 -58.55 -36.19 73.5 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 119.325 0.966 . . . . 0.0 111.784 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 -72.28 -41.44 66.68 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 178.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 83.6 m -58.54 -33.64 70.11 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-O 117.839 -1.077 . . . . 0.0 111.226 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.7 mt -52.98 -29.17 27.47 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.255 1.389 . . . . 0.0 108.143 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -52.45 -44.18 65.35 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.243 1.417 . . . . 0.0 110.5 179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.409 ' HG2' HD22 ' A' ' 11' ' ' LEU . 0.1 OUTLIER -70.14 -28.24 65.21 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 117.977 0.353 . . . . 0.0 111.394 -179.963 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.527 HD12 HD21 ' A' 3316 ' ' LEU . 2.8 mm? -76.15 -54.98 6.02 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 124.156 0.983 . . . . 0.0 109.927 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -41.54 85.36 Favored 'General case' 0 N--CA 1.467 0.415 0 O-C-N 120.306 -1.496 . . . . 0.0 112.519 -178.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? -58.93 -30.52 67.91 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.601 0.637 . . . . 0.0 110.723 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.414 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -75.55 -46.44 32.06 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 178.599 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.4 t -64.46 -38.57 82.92 Favored 'Isoleucine or valine' 0 C--N 1.34 0.168 0 O-C-N 122.021 -0.424 . . . . 0.0 110.322 -179.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 pp -63.42 -41.88 98.71 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 121.344 -0.848 . . . . 0.0 108.962 178.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -57.74 -49.41 76.67 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 119.136 0.88 . . . . 0.0 111.533 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.6 -38.9 87.95 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 120.494 1.497 . . . . 0.0 109.275 178.401 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 39.2 mttp -57.26 -32.5 66.65 Favored 'General case' 0 C--O 1.23 0.069 0 CA-C-O 117.403 -1.284 . . . . 0.0 111.104 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.455 ' O ' HG22 ' A' ' 24' ' ' ILE . 6.7 mm -64.86 -36.97 79.01 Favored 'Isoleucine or valine' 0 C--N 1.344 0.364 0 CA-C-N 121.301 1.864 . . . . 0.0 108.718 178.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 10.3 mtmm -72.38 -30.85 65.06 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.61 0.641 . . . . 0.0 109.523 178.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -68.68 -50.37 51.54 Favored 'General case' 0 CA--C 1.516 -0.349 0 O-C-N 121.721 -0.612 . . . . 0.0 109.687 -179.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.07 -36.62 84.59 Favored 'General case' 0 C--O 1.224 -0.267 0 CA-C-O 118.345 -0.836 . . . . 0.0 111.861 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.455 HG22 ' O ' ' A' ' 20' ' ' ILE . 3.5 tt -75.61 -44.44 40.49 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 120.027 1.285 . . . . 0.0 110.187 179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -72.26 -47.26 51.6 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 118.719 -0.657 . . . . 0.0 112.477 -177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -76.57 -51.14 12.23 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 118.935 0.789 . . . . 0.0 109.039 179.8 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.0 t 55.0 16.94 1.66 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.887 1.675 . . . . 0.0 114.033 -179.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.6 pp -121.88 -172.55 2.46 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 126.813 2.045 . . . . 0.0 111.534 -178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.7 m -127.83 -45.48 1.44 Allowed 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 125.075 1.35 . . . . 0.0 112.912 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.8 t -152.67 31.63 0.51 Allowed 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.799 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 62.32 45.8 6.42 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -66.01 161.33 21.75 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 125.816 1.646 . . . . 0.0 111.636 -179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -115.19 -32.83 5.55 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 123.549 0.74 . . . . 0.0 110.541 179.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -55.6 136.19 47.45 Favored Glycine 0 C--N 1.341 0.811 0 N-CA-C 107.745 -2.142 . . . . 0.0 107.745 178.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 p -140.87 -66.35 0.43 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 117.445 0.623 . . . . 0.0 112.006 -178.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 82.54 157.29 21.59 Favored Glycine 0 CA--C 1.528 0.873 0 N-CA-C 108.901 -1.68 . . . . 0.0 108.901 -178.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 3.4 m -150.95 175.24 12.25 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.284 1.433 . . . . 0.0 108.062 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -177.46 149.36 9.33 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.01 -1.236 . . . . 0.0 110.01 179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -160.15 155.89 25.79 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 46.85 19.4 0.52 Allowed Glycine 0 CA--C 1.531 1.079 0 C-N-CA 126.756 2.122 . . . . 0.0 116.347 179.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.3 p -157.3 160.47 38.59 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.414 1.607 . . . . 0.0 109.496 -178.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 166.92 147.99 5.44 Favored Glycine 0 CA--C 1.523 0.574 0 N-CA-C 108.203 -1.959 . . . . 0.0 108.203 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.3 m -150.79 43.31 0.81 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.349 1.074 . . . . 0.0 110.457 -179.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 104.32 -141.95 15.38 Favored Glycine 0 CA--C 1.526 0.743 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 t 68.52 32.6 4.32 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.164 1.386 . . . . 0.0 111.437 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -113.19 135.75 12.87 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 124.837 1.208 . . . . 0.0 111.469 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.0 p -155.66 177.71 11.08 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.103 0.961 . . . . 0.0 110.075 178.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.21 176.58 47.06 Favored Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.272 -1.531 . . . . 0.0 109.272 179.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -146.13 174.47 11.29 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 163.03 174.46 32.96 Favored Glycine 0 CA--C 1.522 0.491 0 N-CA-C 109.171 -1.571 . . . . 0.0 109.171 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 93.4 p -144.36 -169.39 3.12 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.64 -32.89 8.86 Favored Glycine 0 CA--C 1.526 0.726 0 CA-C-O 118.381 -1.233 . . . . 0.0 114.622 -179.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.2 t -77.35 96.26 4.59 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 119.62 1.71 . . . . 0.0 110.438 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -149.47 120.93 1.21 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.5 p -138.81 -68.57 0.44 Allowed 'General case' 0 C--O 1.235 0.341 0 C-N-CA 124.647 1.179 . . . . 0.0 111.474 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.29 -179.38 32.15 Favored Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.39 1.947 . . . . 0.0 110.131 -178.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.5 m -154.21 124.02 6.72 Favored 'General case' 0 N--CA 1.464 0.275 0 O-C-N 120.56 -1.553 . . . . 0.0 108.651 179.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 104.11 176.51 25.48 Favored Glycine 0 CA--C 1.524 0.643 0 N-CA-C 109.124 -1.591 . . . . 0.0 109.124 -179.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -72.37 43.88 0.11 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.859 1.664 . . . . 0.0 113.127 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 18.3 pt20 -72.87 172.63 10.51 Favored 'General case' 0 C--O 1.234 0.284 0 O-C-N 121.33 -0.856 . . . . 0.0 109.594 178.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 67.0 mt -84.14 104.71 12.78 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.336 0 N-CA-C 102.818 -3.03 . . . . 0.0 102.818 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.51 -15.25 63.21 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.87 0.868 . . . . 0.0 112.777 -178.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 7.0 t -133.22 72.97 1.5 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.644 1.566 . . . . 0.0 111.089 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 3.7 t80 -158.05 -69.58 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.066 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -109.67 13.29 23.85 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 127.509 2.323 . . . . 0.0 114.185 -178.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.91 -34.09 26.96 Favored 'General case' 0 CA--C 1.514 -0.437 0 C-N-CA 126.13 1.772 . . . . 0.0 113.98 -178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 63.4 mm-40 -75.99 -31.22 58.86 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 124.027 0.829 . . . . 0.0 110.544 -178.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 5.1 t70 -81.43 -33.03 32.4 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 123.681 0.793 . . . . 0.0 111.71 177.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -53.74 -45.7 61.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.343 0 C-N-CA 128.16 2.584 . . . . 0.0 110.206 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -63.47 -31.16 72.24 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.248 1.419 . . . . 0.0 110.317 -179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 8.8 t -76.53 -48.3 19.84 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 121.276 -0.89 . . . . 0.0 110.486 -179.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 9.9 p -69.38 -34.71 63.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 121.775 -0.578 . . . . 0.0 110.686 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . 0.414 ' C ' HE21 ' A' 3301 ' ' GLN . 0.0 OUTLIER -71.14 -31.01 67.2 Favored 'General case' 0 N--CA 1.466 0.325 0 O-C-N 120.085 -1.634 . . . . 0.0 109.635 178.588 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 28.9 mtpt -61.63 -28.26 69.25 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 123.617 0.767 . . . . 0.0 110.346 179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -70.13 -41.17 74.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 50.9 mt -73.96 -37.74 64.43 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 115.618 1.711 . . . . 0.0 115.618 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . . . . . . . . . 19.0 pt-20 -62.36 -17.9 60.16 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 121.243 -0.91 . . . . 0.0 113.005 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 7.9 p30 -109.09 -0.75 19.26 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 118.722 -0.656 . . . . 0.0 110.985 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -83.16 152.42 25.27 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.901 0.88 . . . . 0.0 109.007 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 20.1 m -83.96 167.9 16.5 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.918 1.287 . . . . 0.0 110.645 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -60.0 -48.0 83.49 Favored 'General case' 0 C--O 1.211 -0.94 0 O-C-N 120.569 -1.332 . . . . 0.0 108.824 179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.62 -29.64 18.4 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 125.053 1.341 . . . . 0.0 111.227 -177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -81.51 -52.04 7.64 Favored 'General case' 0 N--CA 1.436 -1.129 0 C-N-CA 124.023 0.929 . . . . 0.0 111.407 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 1.4 mt -76.32 -53.65 7.89 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 125.88 1.672 . . . . 0.0 115.032 -177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.41 -40.38 68.19 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 128.794 2.838 . . . . 0.0 106.331 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.04 -29.64 70.55 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 119.82 -0.752 . . . . 0.0 111.939 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -76.66 -56.34 4.7 Favored 'General case' 0 N--CA 1.466 0.364 0 O-C-N 120.573 -1.329 . . . . 0.0 112.094 -178.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.527 HD21 HD12 ' A' ' 11' ' ' LEU . 3.3 pp -62.55 -31.85 72.71 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 123.511 0.724 . . . . 0.0 110.608 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -84.9 -25.83 27.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 118.888 -0.577 . . . . 0.0 110.813 -179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 73.91 33.64 57.19 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -179.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -127.84 176.59 7.45 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 128.048 2.539 . . . . 0.0 109.027 -178.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -149.63 85.62 1.44 Allowed 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 178.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.417 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.109 177.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 29.7 mtm . . . . . 0 N--CA 1.469 0.513 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.1 m-20 -64.66 143.25 58.05 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 -178.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.8 tp -57.8 146.6 7.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-O 122.654 1.216 . . . . 0.0 112.029 -178.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -114.48 -55.04 2.53 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.254 1.821 . . . . 0.0 111.751 -178.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.5 -38.85 78.53 Favored 'General case' 0 N--CA 1.477 0.904 0 CA-C-N 120.281 1.401 . . . . 0.0 112.183 -178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -73.74 -27.03 60.97 Favored 'General case' 0 C--N 1.329 -0.326 0 O-C-N 121.833 -0.542 . . . . 0.0 110.884 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 79.7 m -73.27 -33.84 65.47 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 117.01 -1.471 . . . . 0.0 109.171 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.67 ' HA ' HD23 ' A' ' 11' ' ' LEU . 22.6 mt -52.46 -29.03 22.63 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 126.145 1.778 . . . . 0.0 107.991 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -51.81 -43.25 63.04 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.25 1.42 . . . . 0.0 110.083 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.468 ' HG2' HD22 ' A' ' 11' ' ' LEU . 2.3 ptmm? -68.31 -29.35 68.09 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 119.081 0.855 . . . . 0.0 110.737 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.67 HD23 ' HA ' ' A' ' 8' ' ' LEU . 3.2 mm? -75.12 -53.85 8.14 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 125.095 1.358 . . . . 0.0 110.007 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' 3305 ' ' GLU . 0.0 OUTLIER -60.02 -45.02 94.16 Favored 'General case' 0 CA--C 1.509 -0.618 0 O-C-N 120.467 -1.395 . . . . 0.0 111.283 -178.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -62.72 -31.46 72.38 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 178.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.493 ' HB3' HD22 ' A' 3316 ' ' LEU . . . -70.17 -34.09 72.56 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.127 -1.608 . . . . 0.0 109.632 178.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.2 t -74.71 -48.26 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 123.84 0.856 . . . . 0.0 109.773 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 pp -56.4 -34.65 66.94 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 119.903 1.228 . . . . 0.0 110.631 -179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -53.54 -49.01 68.53 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.943 0.497 . . . . 0.0 110.579 178.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -71.34 -35.66 71.26 Favored 'General case' 0 C--N 1.35 0.591 0 CA-C-N 120.318 1.417 . . . . 0.0 110.9 -179.9 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.8 mttp -55.24 -32.96 62.73 Favored 'General case' 0 N--CA 1.462 0.13 0 CA-C-O 118.014 -0.993 . . . . 0.0 110.287 179.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.427 ' O ' HG22 ' A' ' 24' ' ' ILE . 8.9 mm -59.75 -46.51 93.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 CA-C-N 120.05 1.295 . . . . 0.0 109.118 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.409 ' HE2' ' HA ' ' A' ' 18' ' ' LYS . 43.8 mtmt -65.4 -29.17 69.85 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.985 1.314 . . . . 0.0 111.849 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -77.64 -49.78 13.85 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 117.894 -1.051 . . . . 0.0 109.637 -178.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -34.91 78.98 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.125 0.875 . . . . 0.0 111.952 -179.513 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 20' ' ' ILE . 5.9 tt -69.4 -44.43 80.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 CA-C-N 119.344 0.975 . . . . 0.0 110.443 178.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 6.4 tt0 -75.92 -47.58 24.69 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.455 ' C ' ' H ' ' A' ' 28' ' ' LEU . 10.0 m-80 -73.07 -52.35 14.64 Favored 'General case' 0 CA--C 1.513 -0.446 0 C-N-CA 122.809 0.444 . . . . 0.0 109.947 -178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.4 t 57.3 -8.36 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 128.403 2.681 . . . . 0.0 115.127 -178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.455 ' H ' ' C ' ' A' ' 26' ' ' ASN . 3.9 pp -94.91 179.57 5.18 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 129.139 2.976 . . . . 0.0 110.679 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.2 m -121.72 -61.58 1.49 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.475 178.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.9 t -136.98 36.06 2.59 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.872 1.269 . . . . 0.0 109.186 -178.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 61.09 25.09 15.15 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.21 1.404 . . . . 0.0 111.118 -179.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.9 ttmm -69.91 121.16 16.81 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 128.261 2.624 . . . . 0.0 110.745 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 40.6 p90 -74.25 -34.57 63.65 Favored 'General case' 0 CA--C 1.53 0.198 0 O-C-N 123.849 0.718 . . . . 0.0 110.085 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 79.75 -101.19 1.9 Allowed Glycine 0 C--N 1.335 0.477 0 N-CA-C 107.627 -2.189 . . . . 0.0 107.627 -179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.0 p -178.23 176.25 1.12 Allowed 'General case' 0 C--O 1.241 0.609 0 C-N-CA 124.994 1.318 . . . . 0.0 109.905 179.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 171.91 69.7 0.04 OUTLIER Glycine 0 C--N 1.334 0.45 0 CA-C-O 119.234 -0.759 . . . . 0.0 111.532 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 92.6 p -154.68 176.68 12.13 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.098 0.959 . . . . 0.0 109.421 179.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -103.71 -69.06 0.78 Allowed Glycine 0 C--N 1.337 0.594 0 N-CA-C 108.488 -1.845 . . . . 0.0 108.488 179.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 14.0 m -78.25 69.68 4.49 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.334 1.054 . . . . 0.0 109.388 179.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -173.7 -167.64 33.66 Favored Glycine 0 CA--C 1.524 0.606 0 N-CA-C 108.543 -1.823 . . . . 0.0 108.543 -179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 61.1 m -154.46 146.99 24.06 Favored 'General case' 0 C--O 1.24 0.57 0 O-C-N 121.477 -1.014 . . . . 0.0 109.624 179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -175.44 177.71 47.24 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 127.993 2.711 . . . . 0.0 107.919 179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 84.5 p -162.86 -167.45 1.53 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 117.901 0.851 . . . . 0.0 108.998 -179.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -161.38 173.43 37.78 Favored Glycine 0 N--CA 1.451 -0.343 0 N-CA-C 109.409 -1.476 . . . . 0.0 109.409 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.0 m -156.98 123.03 4.84 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.157 -2.164 . . . . 0.0 105.157 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -79.4 -40.88 14.51 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 109.959 -1.256 . . . . 0.0 109.959 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.4 t 45.02 45.26 8.76 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.938 2.095 . . . . 0.0 113.734 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -143.76 105.5 0.38 Allowed Glycine 0 C--N 1.337 0.62 0 N-CA-C 109.097 -1.601 . . . . 0.0 109.097 179.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 39.9 t -124.33 -66.32 0.99 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.103 1.361 . . . . 0.0 108.575 -179.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.56 176.27 47.08 Favored Glycine 0 CA--C 1.527 0.782 0 C-N-CA 125.114 1.34 . . . . 0.0 111.742 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.1 p -132.95 167.89 19.45 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.541 1.537 . . . . 0.0 109.027 179.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 130.43 -154.84 20.83 Favored Glycine 0 C--N 1.334 0.443 0 N-CA-C 112.028 -0.429 . . . . 0.0 112.028 -179.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.19 91.71 2.59 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 127.895 2.478 . . . . 0.0 106.643 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -58.53 163.34 9.65 Favored Glycine 0 CA--C 1.529 0.925 0 CA-C-O 122.134 0.852 . . . . 0.0 113.421 -179.146 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 27.9 t -132.26 178.19 7.0 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.374 2.27 . . . . 0.0 108.422 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -110.98 179.06 19.9 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 126.093 1.806 . . . . 0.0 110.3 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.6 m -149.77 174.54 12.5 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 124.379 1.072 . . . . 0.0 109.776 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -135.55 -19.14 0.76 Allowed Glycine 0 CA--C 1.529 0.955 0 C-N-CA 123.947 0.784 . . . . 0.0 112.97 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -88.3 4.73 44.94 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.749 1.274 . . . . 0.0 113.938 -179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3288 ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -128.82 -173.9 3.1 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.037 2.135 . . . . 0.0 108.616 -179.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3289 ' ' ILE . . . . . . . . . . . . . 48.1 mt -102.25 93.07 2.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 -179.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3290 ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.36 -7.53 3.08 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 126.644 1.978 . . . . 0.0 114.625 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3291 ' ' THR . . . . . . . . . . . . . 11.1 t -123.22 30.11 6.45 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 125.831 1.652 . . . . 0.0 112.442 -178.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3292 ' ' PHE . . . . . . . . . . . . . 7.0 t80 -142.02 -43.26 0.34 Allowed 'General case' 0 N--CA 1.463 0.219 0 O-C-N 120.735 -1.228 . . . . 0.0 113.004 179.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3293 ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -133.84 4.57 3.58 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3294 ' ' ALA . . . . . . . . . . . . . . . -50.64 -33.14 21.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.824 0.849 . . . . 0.0 112.463 -179.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3295 ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -57.62 -49.15 77.39 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.693 1.197 . . . . 0.0 110.879 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3296 ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -80.17 -29.99 38.79 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.434 -0.792 . . . . 0.0 111.187 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3297 ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.21 -44.57 95.75 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 C-N-CA 125.67 1.588 . . . . 0.0 109.495 -178.141 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3298 ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -63.03 -32.24 73.56 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 123.667 0.604 . . . . 0.0 109.663 -179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3299 ' ' SER . . . . . . . . . . . . . 7.3 t -70.77 -42.95 69.73 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.785 -0.572 . . . . 0.0 110.592 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3300 ' ' VAL . . . . . . . . . . . . . 11.6 p -76.17 -41.4 37.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 119.446 1.021 . . . . 0.0 110.097 179.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3301 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.27 -30.66 71.76 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 120.118 -1.614 . . . . 0.0 109.373 179.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3302 ' ' LYS . . . . . . . . . . . . . 29.6 mtpt -57.74 -27.98 63.5 Favored 'General case' 0 C--N 1.344 0.326 0 C-N-CA 124.229 1.012 . . . . 0.0 110.056 178.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3303 ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -72.98 -49.65 27.82 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 107.524 -1.287 . . . . 0.0 107.524 178.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3304 ' ' LEU . . . . . . . . . . . . . 66.8 mt -64.54 -32.84 74.66 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 115.65 1.722 . . . . 0.0 115.65 -177.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3305 ' ' GLU . . . . . 0.442 ' HA ' ' HD3' ' A' ' 12' ' ' ARG . 8.7 pt-20 -63.84 -18.27 63.97 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 118.436 -0.792 . . . . 0.0 112.763 -179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3306 ' ' ASN . . . . . . . . . . . . . 2.2 p30 -116.23 5.9 13.75 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.042 0.937 . . . . 0.0 112.563 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3307 ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -86.54 155.88 20.31 Favored 'General case' 0 N--CA 1.466 0.334 0 O-C-N 121.207 -0.933 . . . . 0.0 109.084 178.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3308 ' ' SER . . . . . . . . . . . . . 33.1 m -87.04 168.65 13.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.704 1.602 . . . . 0.0 111.046 178.651 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3309 ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' 3313 ' ' LEU . 2.3 mt-10 -56.41 -49.21 75.17 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-O 118.282 -0.866 . . . . 0.0 108.976 -179.758 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3310 ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -52.23 -29.26 21.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 124.741 1.216 . . . . 0.0 112.229 -177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3311 ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -81.59 -52.51 7.13 Favored 'General case' 0 N--CA 1.437 -1.102 0 CA-C-O 121.381 0.61 . . . . 0.0 111.121 179.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3312 ' ' LEU . . . . . . . . . . . . . 2.7 mt -76.47 -54.09 7.2 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.202 1.801 . . . . 0.0 115.263 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3313 ' ' LEU . . . . . 0.408 ' HB3' ' O ' ' A' 3309 ' ' GLU . 1.8 tm? -54.82 -39.28 68.36 Favored 'General case' 0 N--CA 1.447 -0.578 0 C-N-CA 127.979 2.511 . . . . 0.0 105.998 178.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3314 ' ' ALA . . . . . . . . . . . . . . . -65.38 -28.67 69.43 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 119.999 -0.68 . . . . 0.0 112.319 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3315 ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -55.13 5.91 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.617 1.099 . . . . 0.0 111.343 -178.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3316 ' ' LEU . . . . . 0.493 HD22 ' HB3' ' A' ' 14' ' ' ALA . 3.3 pp -62.47 -36.06 81.31 Favored 'General case' 0 C--N 1.338 0.067 0 C-N-CA 122.817 0.447 . . . . 0.0 111.028 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3317 ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -80.84 -26.93 36.66 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 123.139 0.274 . . . . 0.0 111.077 -179.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3318 ' ' GLY . . . . . . . . . . . . . . . 68.68 54.43 15.3 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 106.758 -2.537 . . . . 0.0 106.758 -178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3319 ' ' ASP . . . . . . . . . . . . . 14.3 t70 -59.03 108.45 0.67 Allowed 'General case' 0 C--O 1.232 0.173 0 C-N-CA 126.109 1.764 . . . . 0.0 109.525 -179.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3320 ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -146.86 91.7 2.05 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -179.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3321 ' ' GLN . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.25 1.117 0 N-CA-C 104.364 -2.458 . . . . 0.0 104.364 -179.847 . . . . . . . . 0 0 . 1 stop_ save_